About bis[4-(2-methylbutan-2-yl)phenyl]iodanium;1-(4-butoxynaphthalen-1-yl)thiolan-1-ium;tris(1,4-dimethylpiperazine);3,3-dimethyl-1-(thiolan-1-ium-1-yl)butan-2-one;ethenyl-hydroxy-methylidene-λ4-sulfane;2-[2-hydroxyethyl(methyl)amino]ethanol;4-methoxy-1-methylpiperidine;1-(4-methoxyphenyl)piperidine;bis((4-methylphenyl)-diphenylsulfanium);tetrakis(1-methyl-4-piperidin-1-ylpiperidine);tris(1-methyl-3-(thiolan-1-ium-1-yl)indole);4-oxidoperoxymorpholine;1-phenyl-2-(thiolan-1-ium-1-yl)ethanone;trimethyl-(1-methylpiperidin-4-yl)azanium;bis(1,1,4-trimethylpiperazin-1-ium);pentakis(triphenylsulfanium);tribromide
bis[4-(2-methylbutan-2-yl)phenyl]iodanium;1-(4-butoxynaphthalen-1-yl)thiolan-1-ium;tris(1,4-dimethylpiperazine);3,3-dimethyl-1-(thiolan-1-ium-1-yl)butan-2-one;ethenyl-hydroxy-methylidene-λ4-sulfane;2-[2-hydroxyethyl(methyl)amino]ethanol;4-methoxy-1-methylpiperidine;1-(4-methoxyphenyl)piperidine;bis((4-methylphenyl)-diphenylsulfanium);tetrakis(1-methyl-4-piperidin-1-ylpiperidine);tris(1-methyl-3-(thiolan-1-ium-1-yl)indole);4-oxidoperoxymorpholine;1-phenyl-2-(thiolan-1-ium-1-yl)ethanone;trimethyl-(1-methylpiperidin-4-yl)azanium;bis(1,1,4-trimethylpiperazin-1-ium);pentakis(triphenylsulfanium);tribromide (PubChem CID 159573887) has the molecular formula C345H488Br3IN27O12S14+13
and a molecular weight of 6021.43 g/mol. Its IUPAC name is bis[4-(2-methylbutan-2-yl)phenyl]iodanium;1-(4-butoxynaphthalen-1-yl)thiolan-1-ium;tris(1,4-dimethylpiperazine);3,3-dimethyl-1-(thiolan-1-ium-1-yl)butan-2-one;ethenyl-hydroxy-methylidene-λ4-sulfane;2-[2-hydroxyethyl(methyl)amino]ethanol;4-methoxy-1-methylpiperidine;1-(4-methoxyphenyl)piperidine;bis((4-methylphenyl)-diphenylsulfanium);tetrakis(1-methyl-4-piperidin-1-ylpiperidine);tris(1-methyl-3-(thiolan-1-ium-1-yl)indole);4-oxidoperoxymorpholine;1-phenyl-2-(thiolan-1-ium-1-yl)ethanone;trimethyl-(1-methylpiperidin-4-yl)azanium;bis(1,1,4-trimethylpiperazin-1-ium);pentakis(triphenylsulfanium);tribromide.
Frequently Asked Questions
What is the IUPAC name of bis[4-(2-methylbutan-2-yl)phenyl]iodanium;1-(4-butoxynaphthalen-1-yl)thiolan-1-ium;tris(1,4-dimethylpiperazine);3,3-dimethyl-1-(thiolan-1-ium-1-yl)butan-2-one;ethenyl-hydroxy-methylidene-λ4-sulfane;2-[2-hydroxyethyl(methyl)amino]ethanol;4-methoxy-1-methylpiperidine;1-(4-methoxyphenyl)piperidine;bis((4-methylphenyl)-diphenylsulfanium);tetrakis(1-methyl-4-piperidin-1-ylpiperidine);tris(1-methyl-3-(thiolan-1-ium-1-yl)indole);4-oxidoperoxymorpholine;1-phenyl-2-(thiolan-1-ium-1-yl)ethanone;trimethyl-(1-methylpiperidin-4-yl)azanium;bis(1,1,4-trimethylpiperazin-1-ium);pentakis(triphenylsulfanium);tribromide?
The IUPAC name of bis[4-(2-methylbutan-2-yl)phenyl]iodanium;1-(4-butoxynaphthalen-1-yl)thiolan-1-ium;tris(1,4-dimethylpiperazine);3,3-dimethyl-1-(thiolan-1-ium-1-yl)butan-2-one;ethenyl-hydroxy-methylidene-λ4-sulfane;2-[2-hydroxyethyl(methyl)amino]ethanol;4-methoxy-1-methylpiperidine;1-(4-methoxyphenyl)piperidine;bis((4-methylphenyl)-diphenylsulfanium);tetrakis(1-methyl-4-piperidin-1-ylpiperidine);tris(1-methyl-3-(thiolan-1-ium-1-yl)indole);4-oxidoperoxymorpholine;1-phenyl-2-(thiolan-1-ium-1-yl)ethanone;trimethyl-(1-methylpiperidin-4-yl)azanium;bis(1,1,4-trimethylpiperazin-1-ium);pentakis(triphenylsulfanium);tribromide (CID 159573887) is bis[4-(2-methylbutan-2-yl)phenyl]iodanium;1-(4-butoxynaphthalen-1-yl)thiolan-1-ium;tris(1,4-dimethylpiperazine);3,3-dimethyl-1-(thiolan-1-ium-1-yl)butan-2-one;ethenyl-hydroxy-methylidene-λ4-sulfane;2-[2-hydroxyethyl(methyl)amino]ethanol;4-methoxy-1-methylpiperidine;1-(4-methoxyphenyl)piperidine;bis((4-methylphenyl)-diphenylsulfanium);tetrakis(1-methyl-4-piperidin-1-ylpiperidine);tris(1-methyl-3-(thiolan-1-ium-1-yl)indole);4-oxidoperoxymorpholine;1-phenyl-2-(thiolan-1-ium-1-yl)ethanone;trimethyl-(1-methylpiperidin-4-yl)azanium;bis(1,1,4-trimethylpiperazin-1-ium);pentakis(triphenylsulfanium);tribromide.
What is the SMILES notation for bis[4-(2-methylbutan-2-yl)phenyl]iodanium;1-(4-butoxynaphthalen-1-yl)thiolan-1-ium;tris(1,4-dimethylpiperazine);3,3-dimethyl-1-(thiolan-1-ium-1-yl)butan-2-one;ethenyl-hydroxy-methylidene-λ4-sulfane;2-[2-hydroxyethyl(methyl)amino]ethanol;4-methoxy-1-methylpiperidine;1-(4-methoxyphenyl)piperidine;bis((4-methylphenyl)-diphenylsulfanium);tetrakis(1-methyl-4-piperidin-1-ylpiperidine);tris(1-methyl-3-(thiolan-1-ium-1-yl)indole);4-oxidoperoxymorpholine;1-phenyl-2-(thiolan-1-ium-1-yl)ethanone;trimethyl-(1-methylpiperidin-4-yl)azanium;bis(1,1,4-trimethylpiperazin-1-ium);pentakis(triphenylsulfanium);tribromide?
The canonical SMILES for bis[4-(2-methylbutan-2-yl)phenyl]iodanium;1-(4-butoxynaphthalen-1-yl)thiolan-1-ium;tris(1,4-dimethylpiperazine);3,3-dimethyl-1-(thiolan-1-ium-1-yl)butan-2-one;ethenyl-hydroxy-methylidene-λ4-sulfane;2-[2-hydroxyethyl(methyl)amino]ethanol;4-methoxy-1-methylpiperidine;1-(4-methoxyphenyl)piperidine;bis((4-methylphenyl)-diphenylsulfanium);tetrakis(1-methyl-4-piperidin-1-ylpiperidine);tris(1-methyl-3-(thiolan-1-ium-1-yl)indole);4-oxidoperoxymorpholine;1-phenyl-2-(thiolan-1-ium-1-yl)ethanone;trimethyl-(1-methylpiperidin-4-yl)azanium;bis(1,1,4-trimethylpiperazin-1-ium);pentakis(triphenylsulfanium);tribromide is C=CS(=C)O.CC(C)(C)C(=O)C[S+]1CCCC1.CCC(C)(C)c1ccc([I+]c2ccc(C(C)(C)CC)cc2)cc1.CCCCOc1ccc([S+]2CCCC2)c2ccccc12.CN(CCO)CCO.CN1CCC(N2CCCCC2)CC1.CN1CCC(N2CCCCC2)CC1.CN1CCC(N2CCCCC2)CC1.CN1CCC(N2CCCCC2)CC1.CN1CCC([N+](C)(C)C)CC1.CN1CCN(C)CC1.CN1CCN(C)CC1.CN1CCN(C)CC1.CN1CC[N+](C)(C)CC1.CN1CC[N+](C)(C)CC1.COC1CCN(C)CC1.COc1ccc(N2CCCCC2)cc1.Cc1ccc([S+](c2ccccc2)c2ccccc2)cc1.Cc1ccc([S+](c2ccccc2)c2ccccc2)cc1.Cn1cc([S+]2CCCC2)c2ccccc21.Cn1cc([S+]2CCCC2)c2ccccc21.Cn1cc([S+]2CCCC2)c2ccccc21.O=C(C[S+]1CCCC1)c1ccccc1.[Br-].[Br-].[Br-].[O-]OON1CCOCC1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of bis[4-(2-methylbutan-2-yl)phenyl]iodanium;1-(4-butoxynaphthalen-1-yl)thiolan-1-ium;tris(1,4-dimethylpiperazine);3,3-dimethyl-1-(thiolan-1-ium-1-yl)butan-2-one;ethenyl-hydroxy-methylidene-λ4-sulfane;2-[2-hydroxyethyl(methyl)amino]ethanol;4-methoxy-1-methylpiperidine;1-(4-methoxyphenyl)piperidine;bis((4-methylphenyl)-diphenylsulfanium);tetrakis(1-methyl-4-piperidin-1-ylpiperidine);tris(1-methyl-3-(thiolan-1-ium-1-yl)indole);4-oxidoperoxymorpholine;1-phenyl-2-(thiolan-1-ium-1-yl)ethanone;trimethyl-(1-methylpiperidin-4-yl)azanium;bis(1,1,4-trimethylpiperazin-1-ium);pentakis(triphenylsulfanium);tribromide?
The InChIKey is WDBYXYBZKONFRH-UHFFFAOYSA-J. The full InChI is InChI=1S/C22H30I.2C19H17S.C18H23OS.5C18H15S.3C13H16NS.C12H17NO.C12H15OS.4C11H22N2.C10H19OS.C9H21N2.2C7H17N2.C7H15NO.3C6H14N2.C5H13NO2.C4H9NO4.C3H6OS.3BrH/c1-7-21(3,4)17-9-13-19(14-10-17)23-20-15-11-18(12-16-20)22(5,6)8-2;2*1-16-12-14-19(15-13-16)20(17-8-4-2-5-9-17)18-10-6-3-7-11-18;1-2-3-12-19-17-10-11-18(20-13-6-7-14-20)16-9-5-4-8-15(16)17;5*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;3*1-14-10-13(15-8-4-5-9-15)11-6-2-3-7-12(11)14;1-14-12-7-5-11(6-8-12)13-9-3-2-4-10-13;13-12(10-14-8-4-5-9-14)11-6-2-1-3-7-11;4*1-12-9-5-11(6-10-12)13-7-3-2-4-8-13;1-10(2,3)9(11)8-12-6-4-5-7-12;1-10-7-5-9(6-8-10)11(2,3)4;2*1-8-4-6-9(2,3)7-5-8;1-8-5-3-7(9-2)4-6-8;3*1-7-3-5-8(2)6-4-7;1-6(2-4-7)3-5-8;6-9-8-5-1-3-7-4-2-5;1-3-5(2)4;;;/h9-16H,7-8H2,1-6H3;2*2-15H,1H3;4-5,8-11H,2-3,6-7,12-14H2,1H3;5*1-15H;3*2-3,6-7,10H,4-5,8-9H2,1H3;5-8H,2-4,9-10H2,1H3;1-3,6-7H,4-5,8-10H2;4*11H,2-10H2,1H3;4-8H2,1-3H3;9H,5-8H2,1-4H3;2*4-7H2,1-3H3;7H,3-6H2,1-2H3;3*3-6H2,1-2H3;7-8H,2-5H2,1H3;6H,1-4H2;3-4H,1-2H2;3*1H/q12*+1;;+1;;;;;4*+1;;;;;;;;;;/p-4.
What are the key properties of bis[4-(2-methylbutan-2-yl)phenyl]iodanium;1-(4-butoxynaphthalen-1-yl)thiolan-1-ium;tris(1,4-dimethylpiperazine);3,3-dimethyl-1-(thiolan-1-ium-1-yl)butan-2-one;ethenyl-hydroxy-methylidene-λ4-sulfane;2-[2-hydroxyethyl(methyl)amino]ethanol;4-methoxy-1-methylpiperidine;1-(4-methoxyphenyl)piperidine;bis((4-methylphenyl)-diphenylsulfanium);tetrakis(1-methyl-4-piperidin-1-ylpiperidine);tris(1-methyl-3-(thiolan-1-ium-1-yl)indole);4-oxidoperoxymorpholine;1-phenyl-2-(thiolan-1-ium-1-yl)ethanone;trimethyl-(1-methylpiperidin-4-yl)azanium;bis(1,1,4-trimethylpiperazin-1-ium);pentakis(triphenylsulfanium);tribromide?
bis[4-(2-methylbutan-2-yl)phenyl]iodanium;1-(4-butoxynaphthalen-1-yl)thiolan-1-ium;tris(1,4-dimethylpiperazine);3,3-dimethyl-1-(thiolan-1-ium-1-yl)butan-2-one;ethenyl-hydroxy-methylidene-λ4-sulfane;2-[2-hydroxyethyl(methyl)amino]ethanol;4-methoxy-1-methylpiperidine;1-(4-methoxyphenyl)piperidine;bis((4-methylphenyl)-diphenylsulfanium);tetrakis(1-methyl-4-piperidin-1-ylpiperidine);tris(1-methyl-3-(thiolan-1-ium-1-yl)indole);4-oxidoperoxymorpholine;1-phenyl-2-(thiolan-1-ium-1-yl)ethanone;trimethyl-(1-methylpiperidin-4-yl)azanium;bis(1,1,4-trimethylpiperazin-1-ium);pentakis(triphenylsulfanium);tribromide has a molecular weight of 6021.43 g/mol, XLogP of 54.96, 55 rotatable bonds, 3 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for bis[4-(2-methylbutan-2-yl)phenyl]iodanium;1-(4-butoxynaphthalen-1-yl)thiolan-1-ium;tris(1,4-dimethylpiperazine);3,3-dimethyl-1-(thiolan-1-ium-1-yl)butan-2-one;ethenyl-hydroxy-methylidene-λ4-sulfane;2-[2-hydroxyethyl(methyl)amino]ethanol;4-methoxy-1-methylpiperidine;1-(4-methoxyphenyl)piperidine;bis((4-methylphenyl)-diphenylsulfanium);tetrakis(1-methyl-4-piperidin-1-ylpiperidine);tris(1-methyl-3-(thiolan-1-ium-1-yl)indole);4-oxidoperoxymorpholine;1-phenyl-2-(thiolan-1-ium-1-yl)ethanone;trimethyl-(1-methylpiperidin-4-yl)azanium;bis(1,1,4-trimethylpiperazin-1-ium);pentakis(triphenylsulfanium);tribromide is sourced from PubChem (CID 159573887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).