formaldehyde;(4-formylphenyl) 3-chloro-4-octoxybenzoate;bis((4-formylphenyl) 4-decoxybenzoate);(4-formylphenyl) 4-decylbenzoate;(4-formylphenyl) 6-(4-methylhexoxy)pyridine-3-carboxylate;[6-(2,2,3,3,4,4,4-heptafluorobutoxy)naphthalen-2-yl] 4-decoxybenzoate;[4-(2,2,3,3,4,4,4-heptafluorobutoxy)phenyl] 4-decoxybenzoate;[4-(2,2,3,3,4,4,4-heptafluorobutoxy)phenyl] 6-(4-methylhexoxy)pyridine-3-carboxylate;methyl 4-(4-methylbenzoyl)benzoate;[4-(4-methylphenoxy)phenyl] acetate;bis(2-(4-methylphenyl)-5-octylpyrimidine)

C265H308ClF21N6O38 — CID 157145140

IUPACformaldehyde;(4-formylphenyl) 3-chloro-4-octoxybenzoate;bis((4-formylphenyl) 4-decoxybenzoate);(4-formylphenyl) 4-decylbenzoate;(4-formylphenyl) 6-(4-methylhexoxy)pyridine-3-carboxylate;[6-(2,2,3,3,4,4,4-heptafluorobutoxy)naphthalen-2-yl] 4-decoxybenzoate;[4-(2,2,3,3,4,4,4-heptafluorobutoxy)phenyl] 4-decoxybenzoate;[4-(2,2,3,3,4,4,4-heptafluorobutoxy)phenyl] 6-(4-methylhexoxy)pyridine-3-carboxylate;methyl 4-(4-methylbenzoyl)benzoate;[4-(4-methylphenoxy)phenyl] acetate;bis(2-(4-methylphenyl)-5-octylpyrimidine)
SMILESC=O.CC(=O)Oc1ccc(Oc2ccc(C)cc2)cc1.CCC(C)CCCOc1ccc(C(=O)Oc2ccc(C=O)cc2)cn1.CCC(C)CCCOc1ccc(C(=O)Oc2ccc(OCC(F)(F)C(F)(F)C(F)(F)F)cc2)cn1.CCCCCCCCCCOc1ccc(C(=O)Oc2ccc(C=O)cc2)cc1.CCCCCCCCCCOc1ccc(C(=O)Oc2ccc(C=O)cc2)cc1.CCCCCCCCCCOc1ccc(C(=O)Oc2ccc(OCC(F)(F)C(F)(F)C(F)(F)F)cc2)cc1.CCCCCCCCCCOc1ccc(C(=O)Oc2ccc3cc(OCC(F)(F)C(F)(F)C(F)(F)F)ccc3c2)cc1.CCCCCCCCCCc1ccc(C(=O)Oc2ccc(C=O)cc2)cc1.CCCCCCCCOc1ccc(C(=O)Oc2ccc(C=O)cc2)cc1Cl.CCCCCCCCc1cnc(-c2ccc(C)cc2)nc1.CCCCCCCCc1cnc(-c2ccc(C)cc2)nc1.COC(=O)c1ccc(C(=O)c2ccc(C)cc2)cc1
InChIInChI=1S/C31H33F7O4.C27H31F7O4.2C24H30O4.C24H30O3.C23H24F7NO4.C22H25ClO4.C20H23NO4.2C19H26N2.C16H14O3.C15H14O3.CH2O/c1-2-3-4-5-6-7-8-9-18-40-25-14-10-22(11-15-25)28(39)42-27-17-13-23-19-26(16-12-24(23)20-27)41-21-29(32,33)30(34,35)31(36,37)38;1-2-3-4-5-6-7-8-9-18-36-21-12-10-20(11-13-21)24(35)38-23-16-14-22(15-17-23)37-19-25(28,29)26(30,31)27(32,33)34;2*1-2-3-4-5-6-7-8-9-18-27-22-16-12-21(13-17-22)24(26)28-23-14-10-20(19-25)11-15-23;1-2-3-4-5-6-7-8-9-10-20-11-15-22(16-12-20)24(26)27-23-17-13-21(19-25)14-18-23;1-3-15(2)5-4-12-33-19-11-6-16(13-31-19)20(32)35-18-9-7-17(8-10-18)34-14-21(24,25)22(26,27)23(28,29)30;1-2-3-4-5-6-7-14-26-21-13-10-18(15-20(21)23)22(25)27-19-11-8-17(16-24)9-12-19;1-3-15(2)5-4-12-24-19-11-8-17(13-21-19)20(23)25-18-9-6-16(14-22)7-10-18;2*1-3-4-5-6-7-8-9-17-14-20-19(21-15-17)18-12-10-16(2)11-13-18;1-11-3-5-12(6-4-11)15(17)13-7-9-14(10-8-13)16(18)19-2;1-11-3-5-14(6-4-11)18-15-9-7-13(8-10-15)17-12(2)16;1-2/h10-17,19-20H,2-9,18,21H2,1H3;10-17H,2-9,18-19H2,1H3;2*10-17,19H,2-9,18H2,1H3;11-19H,2-10H2,1H3;6-11,13,15H,3-5,12,14H2,1-2H3;8-13,15-16H,2-7,14H2,1H3;6-11,13-15H,3-5,12H2,1-2H3;2*10-15H,3-9H2,1-2H3;3-10H,1-2H3;3-10H,1-2H3;1H2
InChIKeyAKPRGOMNEHEYDT-UHFFFAOYSA-N
MW4619.79 g/mol
LogP71.70
Rot. Bonds124

About formaldehyde;(4-formylphenyl) 3-chloro-4-octoxybenzoate;bis((4-formylphenyl) 4-decoxybenzoate);(4-formylphenyl) 4-decylbenzoate;(4-formylphenyl) 6-(4-methylhexoxy)pyridine-3-carboxylate;[6-(2,2,3,3,4,4,4-heptafluorobutoxy)naphthalen-2-yl] 4-decoxybenzoate;[4-(2,2,3,3,4,4,4-heptafluorobutoxy)phenyl] 4-decoxybenzoate;[4-(2,2,3,3,4,4,4-heptafluorobutoxy)phenyl] 6-(4-methylhexoxy)pyridine-3-carboxylate;methyl 4-(4-methylbenzoyl)benzoate;[4-(4-methylphenoxy)phenyl] acetate;bis(2-(4-methylphenyl)-5-octylpyrimidine)

formaldehyde;(4-formylphenyl) 3-chloro-4-octoxybenzoate;bis((4-formylphenyl) 4-decoxybenzoate);(4-formylphenyl) 4-decylbenzoate;(4-formylphenyl) 6-(4-methylhexoxy)pyridine-3-carboxylate;[6-(2,2,3,3,4,4,4-heptafluorobutoxy)naphthalen-2-yl] 4-decoxybenzoate;[4-(2,2,3,3,4,4,4-heptafluorobutoxy)phenyl] 4-decoxybenzoate;[4-(2,2,3,3,4,4,4-heptafluorobutoxy)phenyl] 6-(4-methylhexoxy)pyridine-3-carboxylate;methyl 4-(4-methylbenzoyl)benzoate;[4-(4-methylphenoxy)phenyl] acetate;bis(2-(4-methylphenyl)-5-octylpyrimidine) (PubChem CID 157145140) has the molecular formula C265H308ClF21N6O38 and a molecular weight of 4619.79 g/mol. Its IUPAC name is formaldehyde;(4-formylphenyl) 3-chloro-4-octoxybenzoate;bis((4-formylphenyl) 4-decoxybenzoate);(4-formylphenyl) 4-decylbenzoate;(4-formylphenyl) 6-(4-methylhexoxy)pyridine-3-carboxylate;[6-(2,2,3,3,4,4,4-heptafluorobutoxy)naphthalen-2-yl] 4-decoxybenzoate;[4-(2,2,3,3,4,4,4-heptafluorobutoxy)phenyl] 4-decoxybenzoate;[4-(2,2,3,3,4,4,4-heptafluorobutoxy)phenyl] 6-(4-methylhexoxy)pyridine-3-carboxylate;methyl 4-(4-methylbenzoyl)benzoate;[4-(4-methylphenoxy)phenyl] acetate;bis(2-(4-methylphenyl)-5-octylpyrimidine).

Molecular Properties

Compound Nameformaldehyde;(4-formylphenyl) 3-chloro-4-octoxybenzoate;bis((4-formylphenyl) 4-decoxybenzoate);(4-formylphenyl) 4-decylbenzoate;(4-formylphenyl) 6-(4-methylhexoxy)pyridine-3-carboxylate;[6-(2,2,3,3,4,4,4-heptafluorobutoxy)naphthalen-2-yl] 4-decoxybenzoate;[4-(2,2,3,3,4,4,4-heptafluorobutoxy)phenyl] 4-decoxybenzoate;[4-(2,2,3,3,4,4,4-heptafluorobutoxy)phenyl] 6-(4-methylhexoxy)pyridine-3-carboxylate;methyl 4-(4-methylbenzoyl)benzoate;[4-(4-methylphenoxy)phenyl] acetate;bis(2-(4-methylphenyl)-5-octylpyrimidine)
PubChem CID157145140
Molecular FormulaC265H308ClF21N6O38
Molecular Weight4619.79 g/mol
Exact Mass4616.17
IUPAC Nameformaldehyde;(4-formylphenyl) 3-chloro-4-octoxybenzoate;bis((4-formylphenyl) 4-decoxybenzoate);(4-formylphenyl) 4-decylbenzoate;(4-formylphenyl) 6-(4-methylhexoxy)pyridine-3-carboxylate;[6-(2,2,3,3,4,4,4-heptafluorobutoxy)naphthalen-2-yl] 4-decoxybenzoate;[4-(2,2,3,3,4,4,4-heptafluorobutoxy)phenyl] 4-decoxybenzoate;[4-(2,2,3,3,4,4,4-heptafluorobutoxy)phenyl] 6-(4-methylhexoxy)pyridine-3-carboxylate;methyl 4-(4-methylbenzoyl)benzoate;[4-(4-methylphenoxy)phenyl] acetate;bis(2-(4-methylphenyl)-5-octylpyrimidine)
SMILESC=O.CC(=O)Oc1ccc(Oc2ccc(C)cc2)cc1.CCC(C)CCCOc1ccc(C(=O)Oc2ccc(C=O)cc2)cn1.CCC(C)CCCOc1ccc(C(=O)Oc2ccc(OCC(F)(F)C(F)(F)C(F)(F)F)cc2)cn1.CCCCCCCCCCOc1ccc(C(=O)Oc2ccc(C=O)cc2)cc1.CCCCCCCCCCOc1ccc(C(=O)Oc2ccc(C=O)cc2)cc1.CCCCCCCCCCOc1ccc(C(=O)Oc2ccc(OCC(F)(F)C(F)(F)C(F)(F)F)cc2)cc1.CCCCCCCCCCOc1ccc(C(=O)Oc2ccc3cc(OCC(F)(F)C(F)(F)C(F)(F)F)ccc3c2)cc1.CCCCCCCCCCc1ccc(C(=O)Oc2ccc(C=O)cc2)cc1.CCCCCCCCOc1ccc(C(=O)Oc2ccc(C=O)cc2)cc1Cl.CCCCCCCCc1cnc(-c2ccc(C)cc2)nc1.CCCCCCCCc1cnc(-c2ccc(C)cc2)nc1.COC(=O)c1ccc(C(=O)c2ccc(C)cc2)cc1
InChIInChI=1S/C31H33F7O4.C27H31F7O4.2C24H30O4.C24H30O3.C23H24F7NO4.C22H25ClO4.C20H23NO4.2C19H26N2.C16H14O3.C15H14O3.CH2O/c1-2-3-4-5-6-7-8-9-18-40-25-14-10-22(11-15-25)28(39)42-27-17-13-23-19-26(16-12-24(23)20-27)41-21-29(32,33)30(34,35)31(36,37)38;1-2-3-4-5-6-7-8-9-18-36-21-12-10-20(11-13-21)24(35)38-23-16-14-22(15-17-23)37-19-25(28,29)26(30,31)27(32,33)34;2*1-2-3-4-5-6-7-8-9-18-27-22-16-12-21(13-17-22)24(26)28-23-14-10-20(19-25)11-15-23;1-2-3-4-5-6-7-8-9-10-20-11-15-22(16-12-20)24(26)27-23-17-13-21(19-25)14-18-23;1-3-15(2)5-4-12-33-19-11-6-16(13-31-19)20(32)35-18-9-7-17(8-10-18)34-14-21(24,25)22(26,27)23(28,29)30;1-2-3-4-5-6-7-14-26-21-13-10-18(15-20(21)23)22(25)27-19-11-8-17(16-24)9-12-19;1-3-15(2)5-4-12-24-19-11-8-17(13-21-19)20(23)25-18-9-6-16(14-22)7-10-18;2*1-3-4-5-6-7-8-9-17-14-20-19(21-15-17)18-12-10-16(2)11-13-18;1-11-3-5-12(6-4-11)15(17)13-7-9-14(10-8-13)16(18)19-2;1-11-3-5-14(6-4-11)18-15-9-7-13(8-10-15)17-12(2)16;1-2/h10-17,19-20H,2-9,18,21H2,1H3;10-17H,2-9,18-19H2,1H3;2*10-17,19H,2-9,18H2,1H3;11-19H,2-10H2,1H3;6-11,13,15H,3-5,12,14H2,1-2H3;8-13,15-16H,2-7,14H2,1H3;6-11,13-15H,3-5,12H2,1-2H3;2*10-15H,3-9H2,1-2H3;3-10H,1-2H3;3-10H,1-2H3;1H2
InChIKeyAKPRGOMNEHEYDT-UHFFFAOYSA-N
XLogP71.70
TPSA561.36 Ų
H-Bond Donors
H-Bond Acceptors44
Rotatable Bonds124
Heavy Atoms331
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004619.79
LogP ≤ 571.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1044

Analyze formaldehyde;(4-formylphenyl) 3-chloro-4-octoxybenzoate;bis((4-formylphenyl) 4-decoxybenzoate);(4-formylphenyl) 4-decylbenzoate;(4-formylphenyl) 6-(4-methylhexoxy)pyridine-3-carboxylate;[6-(2,2,3,3,4,4,4-heptafluorobutoxy)naphthalen-2-yl] 4-decoxybenzoate;[4-(2,2,3,3,4,4,4-heptafluorobutoxy)phenyl] 4-decoxybenzoate;[4-(2,2,3,3,4,4,4-heptafluorobutoxy)phenyl] 6-(4-methylhexoxy)pyridine-3-carboxylate;methyl 4-(4-methylbenzoyl)benzoate;[4-(4-methylphenoxy)phenyl] acetate;bis(2-(4-methylphenyl)-5-octylpyrimidine) with MolForge

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Related Compounds

[6-[2,2-Difluoro-2-(1,1,2,2,2-pentafluoroethoxy)ethoxy]naphthalen-2-yl] 4-decoxybenzoate;[6-[2,2-difluoro-2-(1,1,2,2,2-pentafluoroethoxy)ethoxy]naphthalen-2-yl] 4-octoxybenzoate;[4-[2,2-difluoro-2-(1,1,2,2,2-pentafluoroethoxy)ethoxy]phenyl] 6-(4-methylhexoxy)pyridine-3-carboxylate;(4-methylphenyl) 3-chloro-4-octoxybenzoate;(4-methylphenyl) 6-(4-methylhexoxy)pyridine-3-carboxylate
CID 53764366
[6-(2,2,3,3,4,4,4-Heptafluorobutoxy)naphthalen-2-yl] 4-decoxybenzoate;[4-(2,2,3,3,4,4,4-heptafluorobutoxy)phenyl] 6-(4-methylhexoxy)pyridine-3-carboxylate;2-(4-methylphenyl)-5-octylpyrimidine
CID 54256366
[4-[2,2-Difluoro-2-(1,1,2,2,2-pentafluoroethoxy)ethoxy]phenyl] 3-chloro-4-octoxybenzoate;[4-[2,2-difluoro-2-(1,1,2,2,2-pentafluoroethoxy)ethoxy]phenyl] 4-decoxybenzoate;2-[4-[4-[2,2-difluoro-2-(1,1,2,2,2-pentafluoroethoxy)ethoxy]phenyl]phenyl]-5-octylpyrimidine;5-hexyl-2-(4-methylphenyl)pyrimidine;2-[4-(4-methylphenyl)phenyl]-5-octylpyrimidine
CID 54338294
Formaldehyde;[6-(2,2,3,3,4,4,4-heptafluorobutoxy)naphthalen-2-yl] 4-decoxybenzoate;[4-(2,2,3,3,4,4,4-heptafluorobutoxy)phenyl] 4-decoxybenzoate;[4-(2,2,3,3,4,4,4-heptafluorobutoxy)phenyl] 6-(4-methylhexoxy)pyridine-3-carboxylate;[4-(4-methylphenoxy)phenyl] acetate;2-(4-methylphenyl)-5-octylpyrimidine
CID 90944170
CID 157448339
CID 157448339
[6-[2,2-Difluoro-2-(1,1,2,2,2-pentafluoroethoxy)ethoxy]naphthalen-2-yl] 4-octoxybenzoate;[4-[2,2-difluoro-2-(1,1,2,2,2-pentafluoroethoxy)ethoxy]phenyl] 6-(4-methylhexoxy)pyridine-3-carboxylate;(4-methylphenyl) 3-chloro-4-octoxybenzoate;(4-methylphenyl) 6-(4-methylhexoxy)pyridine-3-carboxylate
CID 53823458
CID 159249966
CID 159249966
CID 161980510
CID 161980510

Frequently Asked Questions

What is the IUPAC name of formaldehyde;(4-formylphenyl) 3-chloro-4-octoxybenzoate;bis((4-formylphenyl) 4-decoxybenzoate);(4-formylphenyl) 4-decylbenzoate;(4-formylphenyl) 6-(4-methylhexoxy)pyridine-3-carboxylate;[6-(2,2,3,3,4,4,4-heptafluorobutoxy)naphthalen-2-yl] 4-decoxybenzoate;[4-(2,2,3,3,4,4,4-heptafluorobutoxy)phenyl] 4-decoxybenzoate;[4-(2,2,3,3,4,4,4-heptafluorobutoxy)phenyl] 6-(4-methylhexoxy)pyridine-3-carboxylate;methyl 4-(4-methylbenzoyl)benzoate;[4-(4-methylphenoxy)phenyl] acetate;bis(2-(4-methylphenyl)-5-octylpyrimidine)?
The IUPAC name of formaldehyde;(4-formylphenyl) 3-chloro-4-octoxybenzoate;bis((4-formylphenyl) 4-decoxybenzoate);(4-formylphenyl) 4-decylbenzoate;(4-formylphenyl) 6-(4-methylhexoxy)pyridine-3-carboxylate;[6-(2,2,3,3,4,4,4-heptafluorobutoxy)naphthalen-2-yl] 4-decoxybenzoate;[4-(2,2,3,3,4,4,4-heptafluorobutoxy)phenyl] 4-decoxybenzoate;[4-(2,2,3,3,4,4,4-heptafluorobutoxy)phenyl] 6-(4-methylhexoxy)pyridine-3-carboxylate;methyl 4-(4-methylbenzoyl)benzoate;[4-(4-methylphenoxy)phenyl] acetate;bis(2-(4-methylphenyl)-5-octylpyrimidine) (CID 157145140) is formaldehyde;(4-formylphenyl) 3-chloro-4-octoxybenzoate;bis((4-formylphenyl) 4-decoxybenzoate);(4-formylphenyl) 4-decylbenzoate;(4-formylphenyl) 6-(4-methylhexoxy)pyridine-3-carboxylate;[6-(2,2,3,3,4,4,4-heptafluorobutoxy)naphthalen-2-yl] 4-decoxybenzoate;[4-(2,2,3,3,4,4,4-heptafluorobutoxy)phenyl] 4-decoxybenzoate;[4-(2,2,3,3,4,4,4-heptafluorobutoxy)phenyl] 6-(4-methylhexoxy)pyridine-3-carboxylate;methyl 4-(4-methylbenzoyl)benzoate;[4-(4-methylphenoxy)phenyl] acetate;bis(2-(4-methylphenyl)-5-octylpyrimidine).
What is the SMILES notation for formaldehyde;(4-formylphenyl) 3-chloro-4-octoxybenzoate;bis((4-formylphenyl) 4-decoxybenzoate);(4-formylphenyl) 4-decylbenzoate;(4-formylphenyl) 6-(4-methylhexoxy)pyridine-3-carboxylate;[6-(2,2,3,3,4,4,4-heptafluorobutoxy)naphthalen-2-yl] 4-decoxybenzoate;[4-(2,2,3,3,4,4,4-heptafluorobutoxy)phenyl] 4-decoxybenzoate;[4-(2,2,3,3,4,4,4-heptafluorobutoxy)phenyl] 6-(4-methylhexoxy)pyridine-3-carboxylate;methyl 4-(4-methylbenzoyl)benzoate;[4-(4-methylphenoxy)phenyl] acetate;bis(2-(4-methylphenyl)-5-octylpyrimidine)?
The canonical SMILES for formaldehyde;(4-formylphenyl) 3-chloro-4-octoxybenzoate;bis((4-formylphenyl) 4-decoxybenzoate);(4-formylphenyl) 4-decylbenzoate;(4-formylphenyl) 6-(4-methylhexoxy)pyridine-3-carboxylate;[6-(2,2,3,3,4,4,4-heptafluorobutoxy)naphthalen-2-yl] 4-decoxybenzoate;[4-(2,2,3,3,4,4,4-heptafluorobutoxy)phenyl] 4-decoxybenzoate;[4-(2,2,3,3,4,4,4-heptafluorobutoxy)phenyl] 6-(4-methylhexoxy)pyridine-3-carboxylate;methyl 4-(4-methylbenzoyl)benzoate;[4-(4-methylphenoxy)phenyl] acetate;bis(2-(4-methylphenyl)-5-octylpyrimidine) is C=O.CC(=O)Oc1ccc(Oc2ccc(C)cc2)cc1.CCC(C)CCCOc1ccc(C(=O)Oc2ccc(C=O)cc2)cn1.CCC(C)CCCOc1ccc(C(=O)Oc2ccc(OCC(F)(F)C(F)(F)C(F)(F)F)cc2)cn1.CCCCCCCCCCOc1ccc(C(=O)Oc2ccc(C=O)cc2)cc1.CCCCCCCCCCOc1ccc(C(=O)Oc2ccc(C=O)cc2)cc1.CCCCCCCCCCOc1ccc(C(=O)Oc2ccc(OCC(F)(F)C(F)(F)C(F)(F)F)cc2)cc1.CCCCCCCCCCOc1ccc(C(=O)Oc2ccc3cc(OCC(F)(F)C(F)(F)C(F)(F)F)ccc3c2)cc1.CCCCCCCCCCc1ccc(C(=O)Oc2ccc(C=O)cc2)cc1.CCCCCCCCOc1ccc(C(=O)Oc2ccc(C=O)cc2)cc1Cl.CCCCCCCCc1cnc(-c2ccc(C)cc2)nc1.CCCCCCCCc1cnc(-c2ccc(C)cc2)nc1.COC(=O)c1ccc(C(=O)c2ccc(C)cc2)cc1.
What is the InChIKey of formaldehyde;(4-formylphenyl) 3-chloro-4-octoxybenzoate;bis((4-formylphenyl) 4-decoxybenzoate);(4-formylphenyl) 4-decylbenzoate;(4-formylphenyl) 6-(4-methylhexoxy)pyridine-3-carboxylate;[6-(2,2,3,3,4,4,4-heptafluorobutoxy)naphthalen-2-yl] 4-decoxybenzoate;[4-(2,2,3,3,4,4,4-heptafluorobutoxy)phenyl] 4-decoxybenzoate;[4-(2,2,3,3,4,4,4-heptafluorobutoxy)phenyl] 6-(4-methylhexoxy)pyridine-3-carboxylate;methyl 4-(4-methylbenzoyl)benzoate;[4-(4-methylphenoxy)phenyl] acetate;bis(2-(4-methylphenyl)-5-octylpyrimidine)?
The InChIKey is AKPRGOMNEHEYDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H33F7O4.C27H31F7O4.2C24H30O4.C24H30O3.C23H24F7NO4.C22H25ClO4.C20H23NO4.2C19H26N2.C16H14O3.C15H14O3.CH2O/c1-2-3-4-5-6-7-8-9-18-40-25-14-10-22(11-15-25)28(39)42-27-17-13-23-19-26(16-12-24(23)20-27)41-21-29(32,33)30(34,35)31(36,37)38;1-2-3-4-5-6-7-8-9-18-36-21-12-10-20(11-13-21)24(35)38-23-16-14-22(15-17-23)37-19-25(28,29)26(30,31)27(32,33)34;2*1-2-3-4-5-6-7-8-9-18-27-22-16-12-21(13-17-22)24(26)28-23-14-10-20(19-25)11-15-23;1-2-3-4-5-6-7-8-9-10-20-11-15-22(16-12-20)24(26)27-23-17-13-21(19-25)14-18-23;1-3-15(2)5-4-12-33-19-11-6-16(13-31-19)20(32)35-18-9-7-17(8-10-18)34-14-21(24,25)22(26,27)23(28,29)30;1-2-3-4-5-6-7-14-26-21-13-10-18(15-20(21)23)22(25)27-19-11-8-17(16-24)9-12-19;1-3-15(2)5-4-12-24-19-11-8-17(13-21-19)20(23)25-18-9-6-16(14-22)7-10-18;2*1-3-4-5-6-7-8-9-17-14-20-19(21-15-17)18-12-10-16(2)11-13-18;1-11-3-5-12(6-4-11)15(17)13-7-9-14(10-8-13)16(18)19-2;1-11-3-5-14(6-4-11)18-15-9-7-13(8-10-15)17-12(2)16;1-2/h10-17,19-20H,2-9,18,21H2,1H3;10-17H,2-9,18-19H2,1H3;2*10-17,19H,2-9,18H2,1H3;11-19H,2-10H2,1H3;6-11,13,15H,3-5,12,14H2,1-2H3;8-13,15-16H,2-7,14H2,1H3;6-11,13-15H,3-5,12H2,1-2H3;2*10-15H,3-9H2,1-2H3;3-10H,1-2H3;3-10H,1-2H3;1H2.
What are the key properties of formaldehyde;(4-formylphenyl) 3-chloro-4-octoxybenzoate;bis((4-formylphenyl) 4-decoxybenzoate);(4-formylphenyl) 4-decylbenzoate;(4-formylphenyl) 6-(4-methylhexoxy)pyridine-3-carboxylate;[6-(2,2,3,3,4,4,4-heptafluorobutoxy)naphthalen-2-yl] 4-decoxybenzoate;[4-(2,2,3,3,4,4,4-heptafluorobutoxy)phenyl] 4-decoxybenzoate;[4-(2,2,3,3,4,4,4-heptafluorobutoxy)phenyl] 6-(4-methylhexoxy)pyridine-3-carboxylate;methyl 4-(4-methylbenzoyl)benzoate;[4-(4-methylphenoxy)phenyl] acetate;bis(2-(4-methylphenyl)-5-octylpyrimidine)?
formaldehyde;(4-formylphenyl) 3-chloro-4-octoxybenzoate;bis((4-formylphenyl) 4-decoxybenzoate);(4-formylphenyl) 4-decylbenzoate;(4-formylphenyl) 6-(4-methylhexoxy)pyridine-3-carboxylate;[6-(2,2,3,3,4,4,4-heptafluorobutoxy)naphthalen-2-yl] 4-decoxybenzoate;[4-(2,2,3,3,4,4,4-heptafluorobutoxy)phenyl] 4-decoxybenzoate;[4-(2,2,3,3,4,4,4-heptafluorobutoxy)phenyl] 6-(4-methylhexoxy)pyridine-3-carboxylate;methyl 4-(4-methylbenzoyl)benzoate;[4-(4-methylphenoxy)phenyl] acetate;bis(2-(4-methylphenyl)-5-octylpyrimidine) has a molecular weight of 4619.79 g/mol, XLogP of 71.70, 124 rotatable bonds, 0 hydrogen bond donors, and 44 hydrogen bond acceptors.
Where does this data come from?
All data for formaldehyde;(4-formylphenyl) 3-chloro-4-octoxybenzoate;bis((4-formylphenyl) 4-decoxybenzoate);(4-formylphenyl) 4-decylbenzoate;(4-formylphenyl) 6-(4-methylhexoxy)pyridine-3-carboxylate;[6-(2,2,3,3,4,4,4-heptafluorobutoxy)naphthalen-2-yl] 4-decoxybenzoate;[4-(2,2,3,3,4,4,4-heptafluorobutoxy)phenyl] 4-decoxybenzoate;[4-(2,2,3,3,4,4,4-heptafluorobutoxy)phenyl] 6-(4-methylhexoxy)pyridine-3-carboxylate;methyl 4-(4-methylbenzoyl)benzoate;[4-(4-methylphenoxy)phenyl] acetate;bis(2-(4-methylphenyl)-5-octylpyrimidine) is sourced from PubChem (CID 157145140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).