sodium;(3R,4S)-4-aminooxan-3-ol;4-bromo-1,3-dimethylpyrazole;4-[4-(chloromethyl)phenyl]-1,3-dimethylpyrazole;deca-1,3,5,7,9-pentayne;[4-(1,3-dimethylpyrazol-4-yl)phenyl]methanol;4-[[4-(1,3-dimethylpyrazol-4-yl)phenyl]methyl]-N-(3-hydroxyoxan-4-yl)-5-methylpyridine-2-carboxamide;4-[[4-(1,3-dimethylpyrazol-4-yl)phenyl]methyl]-5-methylpyridine-2-carboxylic acid;ethyl 4-[[4-(1,3-dimethylpyrazol-4-yl)phenyl]methyl]-5-methylpyridine-2-carboxylate;ethyl 5-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-2-carboxylate;heptaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65,67,69-pentatriacontayne;heptahexaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65-tritriacontayne;3-hydroxy-1,2-dihydrobenzotriazole;[4-(hydroxymethyl)phenyl]boronic acid;nonahexaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65,67-tetratriacontayne;octahexaconta-2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42,44,46,48,50,52,54,56,58,60,62,64,66-tritriacontayne;phosphanylphosphane;thionyl dichloride;hydroxide;hydrochloride

C410H177B2BrCl4N21NaO20P2S — CID 161075854

IUPACsodium;(3R,4S)-4-aminooxan-3-ol;4-bromo-1,3-dimethylpyrazole;4-[4-(chloromethyl)phenyl]-1,3-dimethylpyrazole;deca-1,3,5,7,9-pentayne;[4-(1,3-dimethylpyrazol-4-yl)phenyl]methanol;4-[[4-(1,3-dimethylpyrazol-4-yl)phenyl]methyl]-N-(3-hydroxyoxan-4-yl)-5-methylpyridine-2-carboxamide;4-[[4-(1,3-dimethylpyrazol-4-yl)phenyl]methyl]-5-methylpyridine-2-carboxylic acid;ethyl 4-[[4-(1,3-dimethylpyrazol-4-yl)phenyl]methyl]-5-methylpyridine-2-carboxylate;ethyl 5-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-2-carboxylate;heptaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65,67,69-pentatriacontayne;heptahexaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65-tritriacontayne;3-hydroxy-1,2-dihydrobenzotriazole;[4-(hydroxymethyl)phenyl]boronic acid;nonahexaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65,67-tetratriacontayne;octahexaconta-2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42,44,46,48,50,52,54,56,58,60,62,64,66-tritriacontayne;phosphanylphosphane;thionyl dichloride;hydroxide;hydrochloride
SMILESC#CC#CC#CC#CC#C.C#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC.C#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC.C#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#C.CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC.CCOC(=O)c1cc(B2OC(C)(C)C(C)(C)O2)c(C)cn1.CCOC(=O)c1cc(Cc2ccc(-c3cn(C)nc3C)cc2)c(C)cn1.Cc1cnc(C(=O)NC2CCOCC2O)cc1Cc1ccc(-c2cn(C)nc2C)cc1.Cc1cnc(C(=O)O)cc1Cc1ccc(-c2cn(C)nc2C)cc1.Cc1nn(C)cc1-c1ccc(CCl)cc1.Cc1nn(C)cc1-c1ccc(CO)cc1.Cc1nn(C)cc1Br.Cl.N[C@H]1CCOC[C@@H]1O.O=S(Cl)Cl.OCc1ccc(B(O)O)cc1.ON1NNc2ccccc21.PP.[Na+].[OH-]
InChIInChI=1S/C70H2.C69H4.C68H6.C67H4.C24H28N4O3.C21H23N3O2.C19H19N3O2.C15H22BNO4.C12H13ClN2.C12H14N2O.C10H2.C7H9BO3.C6H7N3O.C5H7BrN2.C5H11NO2.Cl2OS.ClH.Na.H2O.H4P2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-45-47-49-51-53-55-57-59-61-63-65-67-69-70-68-66-64-62-60-58-56-54-52-50-48-46-44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-45-47-49-51-53-55-57-59-61-63-65-67-69-68-66-64-62-60-58-56-54-52-50-48-46-44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-45-47-49-51-53-55-57-59-61-63-65-67-68-66-64-62-60-58-56-54-52-50-48-46-44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-45-47-49-51-53-55-57-59-61-63-65-67-66-64-62-60-58-56-54-52-50-48-46-44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;1-15-12-25-22(24(30)26-21-8-9-31-14-23(21)29)11-19(15)10-17-4-6-18(7-5-17)20-13-28(3)27-16(20)2;1-5-26-21(25)20-11-18(14(2)12-22-20)10-16-6-8-17(9-7-16)19-13-24(4)23-15(19)3;1-12-10-20-18(19(23)24)9-16(12)8-14-4-6-15(7-5-14)17-11-22(3)21-13(17)2;1-7-19-13(18)12-8-11(10(2)9-17-12)16-20-14(3,4)15(5,6)21-16;1-9-12(8-15(2)14-9)11-5-3-10(7-13)4-6-11;1-9-12(7-14(2)13-9)11-5-3-10(8-15)4-6-11;1-3-5-7-9-10-8-6-4-2;9-5-6-1-3-7(4-2-6)8(10)11;10-9-6-4-2-1-3-5(6)7-8-9;1-4-5(6)3-8(2)7-4;6-4-1-2-8-3-5(4)7;1-4(2)3;;;;1-2/h1-2H;1H,2H3;1-2H3;1H,2H3;4-7,11-13,21,23,29H,8-10,14H2,1-3H3,(H,26,30);6-9,11-13H,5,10H2,1-4H3;4-7,9-11H,8H2,1-3H3,(H,23,24);8-9H,7H2,1-6H3;3-6,8H,7H2,1-2H3;3-7,15H,8H2,1-2H3;1-2H;1-4,9-11H,5H2;1-4,7-8,10H;3H,1-2H3;4-5,7H,1-3,6H2;;1H;;1H2;1-2H2/q;;;;;;;;;;;;;;;;;+1;;/p-1/t;;;;;;;;;;;;;;4-,5-;;;;;/m..............0...../s1
InChIKeyVXLICXIMYNHDPP-ZYDBLZSDSA-M
MW6077.40 g/mol
LogP19.09
Rot. Bonds23

About sodium;(3R,4S)-4-aminooxan-3-ol;4-bromo-1,3-dimethylpyrazole;4-[4-(chloromethyl)phenyl]-1,3-dimethylpyrazole;deca-1,3,5,7,9-pentayne;[4-(1,3-dimethylpyrazol-4-yl)phenyl]methanol;4-[[4-(1,3-dimethylpyrazol-4-yl)phenyl]methyl]-N-(3-hydroxyoxan-4-yl)-5-methylpyridine-2-carboxamide;4-[[4-(1,3-dimethylpyrazol-4-yl)phenyl]methyl]-5-methylpyridine-2-carboxylic acid;ethyl 4-[[4-(1,3-dimethylpyrazol-4-yl)phenyl]methyl]-5-methylpyridine-2-carboxylate;ethyl 5-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-2-carboxylate;heptaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65,67,69-pentatriacontayne;heptahexaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65-tritriacontayne;3-hydroxy-1,2-dihydrobenzotriazole;[4-(hydroxymethyl)phenyl]boronic acid;nonahexaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65,67-tetratriacontayne;octahexaconta-2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42,44,46,48,50,52,54,56,58,60,62,64,66-tritriacontayne;phosphanylphosphane;thionyl dichloride;hydroxide;hydrochloride

sodium;(3R,4S)-4-aminooxan-3-ol;4-bromo-1,3-dimethylpyrazole;4-[4-(chloromethyl)phenyl]-1,3-dimethylpyrazole;deca-1,3,5,7,9-pentayne;[4-(1,3-dimethylpyrazol-4-yl)phenyl]methanol;4-[[4-(1,3-dimethylpyrazol-4-yl)phenyl]methyl]-N-(3-hydroxyoxan-4-yl)-5-methylpyridine-2-carboxamide;4-[[4-(1,3-dimethylpyrazol-4-yl)phenyl]methyl]-5-methylpyridine-2-carboxylic acid;ethyl 4-[[4-(1,3-dimethylpyrazol-4-yl)phenyl]methyl]-5-methylpyridine-2-carboxylate;ethyl 5-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-2-carboxylate;heptaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65,67,69-pentatriacontayne;heptahexaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65-tritriacontayne;3-hydroxy-1,2-dihydrobenzotriazole;[4-(hydroxymethyl)phenyl]boronic acid;nonahexaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65,67-tetratriacontayne;octahexaconta-2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42,44,46,48,50,52,54,56,58,60,62,64,66-tritriacontayne;phosphanylphosphane;thionyl dichloride;hydroxide;hydrochloride (PubChem CID 161075854) has the molecular formula C410H177B2BrCl4N21NaO20P2S and a molecular weight of 6077.40 g/mol. Its IUPAC name is sodium;(3R,4S)-4-aminooxan-3-ol;4-bromo-1,3-dimethylpyrazole;4-[4-(chloromethyl)phenyl]-1,3-dimethylpyrazole;deca-1,3,5,7,9-pentayne;[4-(1,3-dimethylpyrazol-4-yl)phenyl]methanol;4-[[4-(1,3-dimethylpyrazol-4-yl)phenyl]methyl]-N-(3-hydroxyoxan-4-yl)-5-methylpyridine-2-carboxamide;4-[[4-(1,3-dimethylpyrazol-4-yl)phenyl]methyl]-5-methylpyridine-2-carboxylic acid;ethyl 4-[[4-(1,3-dimethylpyrazol-4-yl)phenyl]methyl]-5-methylpyridine-2-carboxylate;ethyl 5-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-2-carboxylate;heptaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65,67,69-pentatriacontayne;heptahexaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65-tritriacontayne;3-hydroxy-1,2-dihydrobenzotriazole;[4-(hydroxymethyl)phenyl]boronic acid;nonahexaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65,67-tetratriacontayne;octahexaconta-2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42,44,46,48,50,52,54,56,58,60,62,64,66-tritriacontayne;phosphanylphosphane;thionyl dichloride;hydroxide;hydrochloride.

Molecular Properties

Compound Namesodium;(3R,4S)-4-aminooxan-3-ol;4-bromo-1,3-dimethylpyrazole;4-[4-(chloromethyl)phenyl]-1,3-dimethylpyrazole;deca-1,3,5,7,9-pentayne;[4-(1,3-dimethylpyrazol-4-yl)phenyl]methanol;4-[[4-(1,3-dimethylpyrazol-4-yl)phenyl]methyl]-N-(3-hydroxyoxan-4-yl)-5-methylpyridine-2-carboxamide;4-[[4-(1,3-dimethylpyrazol-4-yl)phenyl]methyl]-5-methylpyridine-2-carboxylic acid;ethyl 4-[[4-(1,3-dimethylpyrazol-4-yl)phenyl]methyl]-5-methylpyridine-2-carboxylate;ethyl 5-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-2-carboxylate;heptaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65,67,69-pentatriacontayne;heptahexaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65-tritriacontayne;3-hydroxy-1,2-dihydrobenzotriazole;[4-(hydroxymethyl)phenyl]boronic acid;nonahexaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65,67-tetratriacontayne;octahexaconta-2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42,44,46,48,50,52,54,56,58,60,62,64,66-tritriacontayne;phosphanylphosphane;thionyl dichloride;hydroxide;hydrochloride
PubChem CID161075854
Molecular FormulaC410H177B2BrCl4N21NaO20P2S
Molecular Weight6077.40 g/mol
Exact Mass6070.07
IUPAC Namesodium;(3R,4S)-4-aminooxan-3-ol;4-bromo-1,3-dimethylpyrazole;4-[4-(chloromethyl)phenyl]-1,3-dimethylpyrazole;deca-1,3,5,7,9-pentayne;[4-(1,3-dimethylpyrazol-4-yl)phenyl]methanol;4-[[4-(1,3-dimethylpyrazol-4-yl)phenyl]methyl]-N-(3-hydroxyoxan-4-yl)-5-methylpyridine-2-carboxamide;4-[[4-(1,3-dimethylpyrazol-4-yl)phenyl]methyl]-5-methylpyridine-2-carboxylic acid;ethyl 4-[[4-(1,3-dimethylpyrazol-4-yl)phenyl]methyl]-5-methylpyridine-2-carboxylate;ethyl 5-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-2-carboxylate;heptaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65,67,69-pentatriacontayne;heptahexaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65-tritriacontayne;3-hydroxy-1,2-dihydrobenzotriazole;[4-(hydroxymethyl)phenyl]boronic acid;nonahexaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65,67-tetratriacontayne;octahexaconta-2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42,44,46,48,50,52,54,56,58,60,62,64,66-tritriacontayne;phosphanylphosphane;thionyl dichloride;hydroxide;hydrochloride
SMILESC#CC#CC#CC#CC#C.C#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC.C#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC.C#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#C.CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC.CCOC(=O)c1cc(B2OC(C)(C)C(C)(C)O2)c(C)cn1.CCOC(=O)c1cc(Cc2ccc(-c3cn(C)nc3C)cc2)c(C)cn1.Cc1cnc(C(=O)NC2CCOCC2O)cc1Cc1ccc(-c2cn(C)nc2C)cc1.Cc1cnc(C(=O)O)cc1Cc1ccc(-c2cn(C)nc2C)cc1.Cc1nn(C)cc1-c1ccc(CCl)cc1.Cc1nn(C)cc1-c1ccc(CO)cc1.Cc1nn(C)cc1Br.Cl.N[C@H]1CCOC[C@@H]1O.O=S(Cl)Cl.OCc1ccc(B(O)O)cc1.ON1NNc2ccccc21.PP.[Na+].[OH-]
InChIInChI=1S/C70H2.C69H4.C68H6.C67H4.C24H28N4O3.C21H23N3O2.C19H19N3O2.C15H22BNO4.C12H13ClN2.C12H14N2O.C10H2.C7H9BO3.C6H7N3O.C5H7BrN2.C5H11NO2.Cl2OS.ClH.Na.H2O.H4P2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-45-47-49-51-53-55-57-59-61-63-65-67-69-70-68-66-64-62-60-58-56-54-52-50-48-46-44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-45-47-49-51-53-55-57-59-61-63-65-67-69-68-66-64-62-60-58-56-54-52-50-48-46-44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-45-47-49-51-53-55-57-59-61-63-65-67-68-66-64-62-60-58-56-54-52-50-48-46-44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-45-47-49-51-53-55-57-59-61-63-65-67-66-64-62-60-58-56-54-52-50-48-46-44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;1-15-12-25-22(24(30)26-21-8-9-31-14-23(21)29)11-19(15)10-17-4-6-18(7-5-17)20-13-28(3)27-16(20)2;1-5-26-21(25)20-11-18(14(2)12-22-20)10-16-6-8-17(9-7-16)19-13-24(4)23-15(19)3;1-12-10-20-18(19(23)24)9-16(12)8-14-4-6-15(7-5-14)17-11-22(3)21-13(17)2;1-7-19-13(18)12-8-11(10(2)9-17-12)16-20-14(3,4)15(5,6)21-16;1-9-12(8-15(2)14-9)11-5-3-10(7-13)4-6-11;1-9-12(7-14(2)13-9)11-5-3-10(8-15)4-6-11;1-3-5-7-9-10-8-6-4-2;9-5-6-1-3-7(4-2-6)8(10)11;10-9-6-4-2-1-3-5(6)7-8-9;1-4-5(6)3-8(2)7-4;6-4-1-2-8-3-5(4)7;1-4(2)3;;;;1-2/h1-2H;1H,2H3;1-2H3;1H,2H3;4-7,11-13,21,23,29H,8-10,14H2,1-3H3,(H,26,30);6-9,11-13H,5,10H2,1-4H3;4-7,9-11H,8H2,1-3H3,(H,23,24);8-9H,7H2,1-6H3;3-6,8H,7H2,1-2H3;3-7,15H,8H2,1-2H3;1-2H;1-4,9-11H,5H2;1-4,7-8,10H;3H,1-2H3;4-5,7H,1-3,6H2;;1H;;1H2;1-2H2/q;;;;;;;;;;;;;;;;;+1;;/p-1/t;;;;;;;;;;;;;;4-,5-;;;;;/m..............0...../s1
InChIKeyVXLICXIMYNHDPP-ZYDBLZSDSA-M
XLogP19.09
TPSA556.40 Ų
H-Bond Donors12
H-Bond Acceptors39
Rotatable Bonds23
Heavy Atoms462
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5006077.40
LogP ≤ 519.09
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1039

Analyze sodium;(3R,4S)-4-aminooxan-3-ol;4-bromo-1,3-dimethylpyrazole;4-[4-(chloromethyl)phenyl]-1,3-dimethylpyrazole;deca-1,3,5,7,9-pentayne;[4-(1,3-dimethylpyrazol-4-yl)phenyl]methanol;4-[[4-(1,3-dimethylpyrazol-4-yl)phenyl]methyl]-N-(3-hydroxyoxan-4-yl)-5-methylpyridine-2-carboxamide;4-[[4-(1,3-dimethylpyrazol-4-yl)phenyl]methyl]-5-methylpyridine-2-carboxylic acid;ethyl 4-[[4-(1,3-dimethylpyrazol-4-yl)phenyl]methyl]-5-methylpyridine-2-carboxylate;ethyl 5-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-2-carboxylate;heptaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65,67,69-pentatriacontayne;heptahexaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65-tritriacontayne;3-hydroxy-1,2-dihydrobenzotriazole;[4-(hydroxymethyl)phenyl]boronic acid;nonahexaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65,67-tetratriacontayne;octahexaconta-2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42,44,46,48,50,52,54,56,58,60,62,64,66-tritriacontayne;phosphanylphosphane;thionyl dichloride;hydroxide;hydrochloride with MolForge

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Frequently Asked Questions

What is the IUPAC name of sodium;(3R,4S)-4-aminooxan-3-ol;4-bromo-1,3-dimethylpyrazole;4-[4-(chloromethyl)phenyl]-1,3-dimethylpyrazole;deca-1,3,5,7,9-pentayne;[4-(1,3-dimethylpyrazol-4-yl)phenyl]methanol;4-[[4-(1,3-dimethylpyrazol-4-yl)phenyl]methyl]-N-(3-hydroxyoxan-4-yl)-5-methylpyridine-2-carboxamide;4-[[4-(1,3-dimethylpyrazol-4-yl)phenyl]methyl]-5-methylpyridine-2-carboxylic acid;ethyl 4-[[4-(1,3-dimethylpyrazol-4-yl)phenyl]methyl]-5-methylpyridine-2-carboxylate;ethyl 5-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-2-carboxylate;heptaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65,67,69-pentatriacontayne;heptahexaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65-tritriacontayne;3-hydroxy-1,2-dihydrobenzotriazole;[4-(hydroxymethyl)phenyl]boronic acid;nonahexaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65,67-tetratriacontayne;octahexaconta-2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42,44,46,48,50,52,54,56,58,60,62,64,66-tritriacontayne;phosphanylphosphane;thionyl dichloride;hydroxide;hydrochloride?
The IUPAC name of sodium;(3R,4S)-4-aminooxan-3-ol;4-bromo-1,3-dimethylpyrazole;4-[4-(chloromethyl)phenyl]-1,3-dimethylpyrazole;deca-1,3,5,7,9-pentayne;[4-(1,3-dimethylpyrazol-4-yl)phenyl]methanol;4-[[4-(1,3-dimethylpyrazol-4-yl)phenyl]methyl]-N-(3-hydroxyoxan-4-yl)-5-methylpyridine-2-carboxamide;4-[[4-(1,3-dimethylpyrazol-4-yl)phenyl]methyl]-5-methylpyridine-2-carboxylic acid;ethyl 4-[[4-(1,3-dimethylpyrazol-4-yl)phenyl]methyl]-5-methylpyridine-2-carboxylate;ethyl 5-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-2-carboxylate;heptaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65,67,69-pentatriacontayne;heptahexaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65-tritriacontayne;3-hydroxy-1,2-dihydrobenzotriazole;[4-(hydroxymethyl)phenyl]boronic acid;nonahexaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65,67-tetratriacontayne;octahexaconta-2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42,44,46,48,50,52,54,56,58,60,62,64,66-tritriacontayne;phosphanylphosphane;thionyl dichloride;hydroxide;hydrochloride (CID 161075854) is sodium;(3R,4S)-4-aminooxan-3-ol;4-bromo-1,3-dimethylpyrazole;4-[4-(chloromethyl)phenyl]-1,3-dimethylpyrazole;deca-1,3,5,7,9-pentayne;[4-(1,3-dimethylpyrazol-4-yl)phenyl]methanol;4-[[4-(1,3-dimethylpyrazol-4-yl)phenyl]methyl]-N-(3-hydroxyoxan-4-yl)-5-methylpyridine-2-carboxamide;4-[[4-(1,3-dimethylpyrazol-4-yl)phenyl]methyl]-5-methylpyridine-2-carboxylic acid;ethyl 4-[[4-(1,3-dimethylpyrazol-4-yl)phenyl]methyl]-5-methylpyridine-2-carboxylate;ethyl 5-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-2-carboxylate;heptaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65,67,69-pentatriacontayne;heptahexaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65-tritriacontayne;3-hydroxy-1,2-dihydrobenzotriazole;[4-(hydroxymethyl)phenyl]boronic acid;nonahexaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65,67-tetratriacontayne;octahexaconta-2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42,44,46,48,50,52,54,56,58,60,62,64,66-tritriacontayne;phosphanylphosphane;thionyl dichloride;hydroxide;hydrochloride.
What is the SMILES notation for sodium;(3R,4S)-4-aminooxan-3-ol;4-bromo-1,3-dimethylpyrazole;4-[4-(chloromethyl)phenyl]-1,3-dimethylpyrazole;deca-1,3,5,7,9-pentayne;[4-(1,3-dimethylpyrazol-4-yl)phenyl]methanol;4-[[4-(1,3-dimethylpyrazol-4-yl)phenyl]methyl]-N-(3-hydroxyoxan-4-yl)-5-methylpyridine-2-carboxamide;4-[[4-(1,3-dimethylpyrazol-4-yl)phenyl]methyl]-5-methylpyridine-2-carboxylic acid;ethyl 4-[[4-(1,3-dimethylpyrazol-4-yl)phenyl]methyl]-5-methylpyridine-2-carboxylate;ethyl 5-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-2-carboxylate;heptaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65,67,69-pentatriacontayne;heptahexaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65-tritriacontayne;3-hydroxy-1,2-dihydrobenzotriazole;[4-(hydroxymethyl)phenyl]boronic acid;nonahexaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65,67-tetratriacontayne;octahexaconta-2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42,44,46,48,50,52,54,56,58,60,62,64,66-tritriacontayne;phosphanylphosphane;thionyl dichloride;hydroxide;hydrochloride?
The canonical SMILES for sodium;(3R,4S)-4-aminooxan-3-ol;4-bromo-1,3-dimethylpyrazole;4-[4-(chloromethyl)phenyl]-1,3-dimethylpyrazole;deca-1,3,5,7,9-pentayne;[4-(1,3-dimethylpyrazol-4-yl)phenyl]methanol;4-[[4-(1,3-dimethylpyrazol-4-yl)phenyl]methyl]-N-(3-hydroxyoxan-4-yl)-5-methylpyridine-2-carboxamide;4-[[4-(1,3-dimethylpyrazol-4-yl)phenyl]methyl]-5-methylpyridine-2-carboxylic acid;ethyl 4-[[4-(1,3-dimethylpyrazol-4-yl)phenyl]methyl]-5-methylpyridine-2-carboxylate;ethyl 5-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-2-carboxylate;heptaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65,67,69-pentatriacontayne;heptahexaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65-tritriacontayne;3-hydroxy-1,2-dihydrobenzotriazole;[4-(hydroxymethyl)phenyl]boronic acid;nonahexaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65,67-tetratriacontayne;octahexaconta-2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42,44,46,48,50,52,54,56,58,60,62,64,66-tritriacontayne;phosphanylphosphane;thionyl dichloride;hydroxide;hydrochloride is C#CC#CC#CC#CC#C.C#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC.C#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC.C#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#C.CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC.CCOC(=O)c1cc(B2OC(C)(C)C(C)(C)O2)c(C)cn1.CCOC(=O)c1cc(Cc2ccc(-c3cn(C)nc3C)cc2)c(C)cn1.Cc1cnc(C(=O)NC2CCOCC2O)cc1Cc1ccc(-c2cn(C)nc2C)cc1.Cc1cnc(C(=O)O)cc1Cc1ccc(-c2cn(C)nc2C)cc1.Cc1nn(C)cc1-c1ccc(CCl)cc1.Cc1nn(C)cc1-c1ccc(CO)cc1.Cc1nn(C)cc1Br.Cl.N[C@H]1CCOC[C@@H]1O.O=S(Cl)Cl.OCc1ccc(B(O)O)cc1.ON1NNc2ccccc21.PP.[Na+].[OH-].
What is the InChIKey of sodium;(3R,4S)-4-aminooxan-3-ol;4-bromo-1,3-dimethylpyrazole;4-[4-(chloromethyl)phenyl]-1,3-dimethylpyrazole;deca-1,3,5,7,9-pentayne;[4-(1,3-dimethylpyrazol-4-yl)phenyl]methanol;4-[[4-(1,3-dimethylpyrazol-4-yl)phenyl]methyl]-N-(3-hydroxyoxan-4-yl)-5-methylpyridine-2-carboxamide;4-[[4-(1,3-dimethylpyrazol-4-yl)phenyl]methyl]-5-methylpyridine-2-carboxylic acid;ethyl 4-[[4-(1,3-dimethylpyrazol-4-yl)phenyl]methyl]-5-methylpyridine-2-carboxylate;ethyl 5-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-2-carboxylate;heptaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65,67,69-pentatriacontayne;heptahexaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65-tritriacontayne;3-hydroxy-1,2-dihydrobenzotriazole;[4-(hydroxymethyl)phenyl]boronic acid;nonahexaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65,67-tetratriacontayne;octahexaconta-2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42,44,46,48,50,52,54,56,58,60,62,64,66-tritriacontayne;phosphanylphosphane;thionyl dichloride;hydroxide;hydrochloride?
The InChIKey is VXLICXIMYNHDPP-ZYDBLZSDSA-M. The full InChI is InChI=1S/C70H2.C69H4.C68H6.C67H4.C24H28N4O3.C21H23N3O2.C19H19N3O2.C15H22BNO4.C12H13ClN2.C12H14N2O.C10H2.C7H9BO3.C6H7N3O.C5H7BrN2.C5H11NO2.Cl2OS.ClH.Na.H2O.H4P2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-45-47-49-51-53-55-57-59-61-63-65-67-69-70-68-66-64-62-60-58-56-54-52-50-48-46-44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-45-47-49-51-53-55-57-59-61-63-65-67-69-68-66-64-62-60-58-56-54-52-50-48-46-44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-45-47-49-51-53-55-57-59-61-63-65-67-68-66-64-62-60-58-56-54-52-50-48-46-44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-45-47-49-51-53-55-57-59-61-63-65-67-66-64-62-60-58-56-54-52-50-48-46-44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;1-15-12-25-22(24(30)26-21-8-9-31-14-23(21)29)11-19(15)10-17-4-6-18(7-5-17)20-13-28(3)27-16(20)2;1-5-26-21(25)20-11-18(14(2)12-22-20)10-16-6-8-17(9-7-16)19-13-24(4)23-15(19)3;1-12-10-20-18(19(23)24)9-16(12)8-14-4-6-15(7-5-14)17-11-22(3)21-13(17)2;1-7-19-13(18)12-8-11(10(2)9-17-12)16-20-14(3,4)15(5,6)21-16;1-9-12(8-15(2)14-9)11-5-3-10(7-13)4-6-11;1-9-12(7-14(2)13-9)11-5-3-10(8-15)4-6-11;1-3-5-7-9-10-8-6-4-2;9-5-6-1-3-7(4-2-6)8(10)11;10-9-6-4-2-1-3-5(6)7-8-9;1-4-5(6)3-8(2)7-4;6-4-1-2-8-3-5(4)7;1-4(2)3;;;;1-2/h1-2H;1H,2H3;1-2H3;1H,2H3;4-7,11-13,21,23,29H,8-10,14H2,1-3H3,(H,26,30);6-9,11-13H,5,10H2,1-4H3;4-7,9-11H,8H2,1-3H3,(H,23,24);8-9H,7H2,1-6H3;3-6,8H,7H2,1-2H3;3-7,15H,8H2,1-2H3;1-2H;1-4,9-11H,5H2;1-4,7-8,10H;3H,1-2H3;4-5,7H,1-3,6H2;;1H;;1H2;1-2H2/q;;;;;;;;;;;;;;;;;+1;;/p-1/t;;;;;;;;;;;;;;4-,5-;;;;;/m..............0...../s1.
What are the key properties of sodium;(3R,4S)-4-aminooxan-3-ol;4-bromo-1,3-dimethylpyrazole;4-[4-(chloromethyl)phenyl]-1,3-dimethylpyrazole;deca-1,3,5,7,9-pentayne;[4-(1,3-dimethylpyrazol-4-yl)phenyl]methanol;4-[[4-(1,3-dimethylpyrazol-4-yl)phenyl]methyl]-N-(3-hydroxyoxan-4-yl)-5-methylpyridine-2-carboxamide;4-[[4-(1,3-dimethylpyrazol-4-yl)phenyl]methyl]-5-methylpyridine-2-carboxylic acid;ethyl 4-[[4-(1,3-dimethylpyrazol-4-yl)phenyl]methyl]-5-methylpyridine-2-carboxylate;ethyl 5-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-2-carboxylate;heptaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65,67,69-pentatriacontayne;heptahexaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65-tritriacontayne;3-hydroxy-1,2-dihydrobenzotriazole;[4-(hydroxymethyl)phenyl]boronic acid;nonahexaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65,67-tetratriacontayne;octahexaconta-2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42,44,46,48,50,52,54,56,58,60,62,64,66-tritriacontayne;phosphanylphosphane;thionyl dichloride;hydroxide;hydrochloride?
sodium;(3R,4S)-4-aminooxan-3-ol;4-bromo-1,3-dimethylpyrazole;4-[4-(chloromethyl)phenyl]-1,3-dimethylpyrazole;deca-1,3,5,7,9-pentayne;[4-(1,3-dimethylpyrazol-4-yl)phenyl]methanol;4-[[4-(1,3-dimethylpyrazol-4-yl)phenyl]methyl]-N-(3-hydroxyoxan-4-yl)-5-methylpyridine-2-carboxamide;4-[[4-(1,3-dimethylpyrazol-4-yl)phenyl]methyl]-5-methylpyridine-2-carboxylic acid;ethyl 4-[[4-(1,3-dimethylpyrazol-4-yl)phenyl]methyl]-5-methylpyridine-2-carboxylate;ethyl 5-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-2-carboxylate;heptaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65,67,69-pentatriacontayne;heptahexaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65-tritriacontayne;3-hydroxy-1,2-dihydrobenzotriazole;[4-(hydroxymethyl)phenyl]boronic acid;nonahexaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65,67-tetratriacontayne;octahexaconta-2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42,44,46,48,50,52,54,56,58,60,62,64,66-tritriacontayne;phosphanylphosphane;thionyl dichloride;hydroxide;hydrochloride has a molecular weight of 6077.40 g/mol, XLogP of 19.09, 23 rotatable bonds, 12 hydrogen bond donors, and 39 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;(3R,4S)-4-aminooxan-3-ol;4-bromo-1,3-dimethylpyrazole;4-[4-(chloromethyl)phenyl]-1,3-dimethylpyrazole;deca-1,3,5,7,9-pentayne;[4-(1,3-dimethylpyrazol-4-yl)phenyl]methanol;4-[[4-(1,3-dimethylpyrazol-4-yl)phenyl]methyl]-N-(3-hydroxyoxan-4-yl)-5-methylpyridine-2-carboxamide;4-[[4-(1,3-dimethylpyrazol-4-yl)phenyl]methyl]-5-methylpyridine-2-carboxylic acid;ethyl 4-[[4-(1,3-dimethylpyrazol-4-yl)phenyl]methyl]-5-methylpyridine-2-carboxylate;ethyl 5-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-2-carboxylate;heptaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65,67,69-pentatriacontayne;heptahexaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65-tritriacontayne;3-hydroxy-1,2-dihydrobenzotriazole;[4-(hydroxymethyl)phenyl]boronic acid;nonahexaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65,67-tetratriacontayne;octahexaconta-2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42,44,46,48,50,52,54,56,58,60,62,64,66-tritriacontayne;phosphanylphosphane;thionyl dichloride;hydroxide;hydrochloride is sourced from PubChem (CID 161075854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).