2-tert-butyl-6-(5-chlorobenzotriazol-2-yl)-4-methylphenol;ethyl 3,3-bis(3-tert-butyl-4-hydroxyphenyl)butanoate;ethyl 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoate;(2-hydroxy-4-octoxyphenyl)-phenylmethanone;4-O-[2-(4-methoxy-2,2,6,6-tetramethylpiperidin-1-yl)ethyl] 1-O-methyl butanedioate;6-methyl-2-N-[8-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]octyl]-2-N-(2,2,6,6-tetramethylpiperidin-4-yl)-4-N-(2,4,4-trimethylpentan-2-yl)-1,3,5-triazine-2,4-diamine

C139H217ClN12O16 — CID 157122147

About 2-tert-butyl-6-(5-chlorobenzotriazol-2-yl)-4-methylphenol;ethyl 3,3-bis(3-tert-butyl-4-hydroxyphenyl)butanoate;ethyl 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoate;(2-hydroxy-4-octoxyphenyl)-phenylmethanone;4-O-[2-(4-methoxy-2,2,6,6-tetramethylpiperidin-1-yl)ethyl] 1-O-methyl butanedioate;6-methyl-2-N-[8-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]octyl]-2-N-(2,2,6,6-tetramethylpiperidin-4-yl)-4-N-(2,4,4-trimethylpentan-2-yl)-1,3,5-triazine-2,4-diamine

2-tert-butyl-6-(5-chlorobenzotriazol-2-yl)-4-methylphenol;ethyl 3,3-bis(3-tert-butyl-4-hydroxyphenyl)butanoate;ethyl 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoate;(2-hydroxy-4-octoxyphenyl)-phenylmethanone;4-O-[2-(4-methoxy-2,2,6,6-tetramethylpiperidin-1-yl)ethyl] 1-O-methyl butanedioate;6-methyl-2-N-[8-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]octyl]-2-N-(2,2,6,6-tetramethylpiperidin-4-yl)-4-N-(2,4,4-trimethylpentan-2-yl)-1,3,5-triazine-2,4-diamine (PubChem CID 157122147) has the molecular formula C139H217ClN12O16 and a molecular weight of 2347.79 g/mol. Its IUPAC name is 2-tert-butyl-6-(5-chlorobenzotriazol-2-yl)-4-methylphenol;ethyl 3,3-bis(3-tert-butyl-4-hydroxyphenyl)butanoate;ethyl 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoate;(2-hydroxy-4-octoxyphenyl)-phenylmethanone;4-O-[2-(4-methoxy-2,2,6,6-tetramethylpiperidin-1-yl)ethyl] 1-O-methyl butanedioate;6-methyl-2-N-[8-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]octyl]-2-N-(2,2,6,6-tetramethylpiperidin-4-yl)-4-N-(2,4,4-trimethylpentan-2-yl)-1,3,5-triazine-2,4-diamine.

Molecular Properties

• Compound Name: 2-tert-butyl-6-(5-chlorobenzotriazol-2-yl)-4-methylphenol;ethyl 3,3-bis(3-tert-butyl-4-hydroxyphenyl)butanoate;ethyl 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoate;(2-hydroxy-4-octoxyphenyl)-phenylmethanone;4-O-[2-(4-methoxy-2,2,6,6-tetramethylpiperidin-1-yl)ethyl] 1-O-methyl butanedioate;6-methyl-2-N-[8-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]octyl]-2-N-(2,2,6,6-tetramethylpiperidin-4-yl)-4-N-(2,4,4-trimethylpentan-2-yl)-1,3,5-triazine-2,4-diamine
• PubChem CID: 157122147
• Molecular Formula: C139H217ClN12O16
• Molecular Weight: 2347.79 g/mol
• Exact Mass: 2345.62
• IUPAC Name: 2-tert-butyl-6-(5-chlorobenzotriazol-2-yl)-4-methylphenol;ethyl 3,3-bis(3-tert-butyl-4-hydroxyphenyl)butanoate;ethyl 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoate;(2-hydroxy-4-octoxyphenyl)-phenylmethanone;4-O-[2-(4-methoxy-2,2,6,6-tetramethylpiperidin-1-yl)ethyl] 1-O-methyl butanedioate;6-methyl-2-N-[8-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]octyl]-2-N-(2,2,6,6-tetramethylpiperidin-4-yl)-4-N-(2,4,4-trimethylpentan-2-yl)-1,3,5-triazine-2,4-diamine
• SMILES: CCCCCCCCOc1ccc(C(=O)c2ccccc2)c(O)c1.CCOC(=O)CC(C)(c1ccc(O)c(C(C)(C)C)c1)c1ccc(O)c(C(C)(C)C)c1.CCOC(=O)CCc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1.COC(=O)CCC(=O)OCCN1C(C)(C)CC(OC)CC1(C)C.Cc1cc(-n2nc3ccc(Cl)cc3n2)c(O)c(C(C)(C)C)c1.Cc1nc(NC(C)(C)CC(C)(C)C)nc(N(CCCCCCCCN(C)C2CC(C)(C)NC(C)(C)C2)C2CC(C)(C)NC(C)(C)C2)n1
• InChI: InChI=1S/C39H76N8.C26H36O4.C21H26O3.C19H30O3.C17H18ClN3O.C17H31NO5/c1-29-40-32(43-39(13,14)28-34(2,3)4)42-33(41-29)47(31-26-37(9,10)45-38(11,12)27-31)23-21-19-17-16-18-20-22-46(15)30-24-35(5,6)44-36(7,8)25-30;1-9-30-23(29)16-26(8,17-10-12-21(27)19(14-17)24(2,3)4)18-11-13-22(28)20(15-18)25(5,6)7;1-2-3-4-5-6-10-15-24-18-13-14-19(20(22)16-18)21(23)17-11-8-7-9-12-17;1-8-22-16(20)10-9-13-11-14(18(2,3)4)17(21)15(12-13)19(5,6)7;1-10-7-12(17(2,3)4)16(22)15(8-10)21-19-13-6-5-11(18)9-14(13)20-21;1-16(2)11-13(21-5)12-17(3,4)18(16)9-10-23-15(20)8-7-14(19)22-6/h30-31,44-45H,16-28H2,1-15H3,(H,40,41,42,43);10-15,27-28H,9,16H2,1-8H3;7-9,11-14,16,22H,2-6,10,15H2,1H3;11-12,21H,8-10H2,1-7H3;5-9,22H,1-4H3;13H,7-12H2,1-6H3
• InChIKey: AICBGZARVAYBIB-UHFFFAOYSA-N
• XLogP: 30.84
• TPSA: 357.07 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 28
• Rotatable Bonds: 42
• Heavy Atoms: 168
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2347.79
LogP ≤ 5	30.84
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	28

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-6-(5-chlorobenzotriazol-2-yl)-4-methylphenol;ethyl 3,3-bis(3-tert-butyl-4-hydroxyphenyl)butanoate;ethyl 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoate;(2-hydroxy-4-octoxyphenyl)-phenylmethanone;4-O-[2-(4-methoxy-2,2,6,6-tetramethylpiperidin-1-yl)ethyl] 1-O-methyl butanedioate;6-methyl-2-N-[8-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]octyl]-2-N-(2,2,6,6-tetramethylpiperidin-4-yl)-4-N-(2,4,4-trimethylpentan-2-yl)-1,3,5-triazine-2,4-diamine?

The IUPAC name of 2-tert-butyl-6-(5-chlorobenzotriazol-2-yl)-4-methylphenol;ethyl 3,3-bis(3-tert-butyl-4-hydroxyphenyl)butanoate;ethyl 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoate;(2-hydroxy-4-octoxyphenyl)-phenylmethanone;4-O-[2-(4-methoxy-2,2,6,6-tetramethylpiperidin-1-yl)ethyl] 1-O-methyl butanedioate;6-methyl-2-N-[8-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]octyl]-2-N-(2,2,6,6-tetramethylpiperidin-4-yl)-4-N-(2,4,4-trimethylpentan-2-yl)-1,3,5-triazine-2,4-diamine (CID 157122147) is 2-tert-butyl-6-(5-chlorobenzotriazol-2-yl)-4-methylphenol;ethyl 3,3-bis(3-tert-butyl-4-hydroxyphenyl)butanoate;ethyl 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoate;(2-hydroxy-4-octoxyphenyl)-phenylmethanone;4-O-[2-(4-methoxy-2,2,6,6-tetramethylpiperidin-1-yl)ethyl] 1-O-methyl butanedioate;6-methyl-2-N-[8-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]octyl]-2-N-(2,2,6,6-tetramethylpiperidin-4-yl)-4-N-(2,4,4-trimethylpentan-2-yl)-1,3,5-triazine-2,4-diamine.

What is the SMILES notation for 2-tert-butyl-6-(5-chlorobenzotriazol-2-yl)-4-methylphenol;ethyl 3,3-bis(3-tert-butyl-4-hydroxyphenyl)butanoate;ethyl 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoate;(2-hydroxy-4-octoxyphenyl)-phenylmethanone;4-O-[2-(4-methoxy-2,2,6,6-tetramethylpiperidin-1-yl)ethyl] 1-O-methyl butanedioate;6-methyl-2-N-[8-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]octyl]-2-N-(2,2,6,6-tetramethylpiperidin-4-yl)-4-N-(2,4,4-trimethylpentan-2-yl)-1,3,5-triazine-2,4-diamine?

The canonical SMILES for 2-tert-butyl-6-(5-chlorobenzotriazol-2-yl)-4-methylphenol;ethyl 3,3-bis(3-tert-butyl-4-hydroxyphenyl)butanoate;ethyl 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoate;(2-hydroxy-4-octoxyphenyl)-phenylmethanone;4-O-[2-(4-methoxy-2,2,6,6-tetramethylpiperidin-1-yl)ethyl] 1-O-methyl butanedioate;6-methyl-2-N-[8-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]octyl]-2-N-(2,2,6,6-tetramethylpiperidin-4-yl)-4-N-(2,4,4-trimethylpentan-2-yl)-1,3,5-triazine-2,4-diamine is CCCCCCCCOc1ccc(C(=O)c2ccccc2)c(O)c1.CCOC(=O)CC(C)(c1ccc(O)c(C(C)(C)C)c1)c1ccc(O)c(C(C)(C)C)c1.CCOC(=O)CCc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1.COC(=O)CCC(=O)OCCN1C(C)(C)CC(OC)CC1(C)C.Cc1cc(-n2nc3ccc(Cl)cc3n2)c(O)c(C(C)(C)C)c1.Cc1nc(NC(C)(C)CC(C)(C)C)nc(N(CCCCCCCCN(C)C2CC(C)(C)NC(C)(C)C2)C2CC(C)(C)NC(C)(C)C2)n1.

What is the InChIKey of 2-tert-butyl-6-(5-chlorobenzotriazol-2-yl)-4-methylphenol;ethyl 3,3-bis(3-tert-butyl-4-hydroxyphenyl)butanoate;ethyl 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoate;(2-hydroxy-4-octoxyphenyl)-phenylmethanone;4-O-[2-(4-methoxy-2,2,6,6-tetramethylpiperidin-1-yl)ethyl] 1-O-methyl butanedioate;6-methyl-2-N-[8-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]octyl]-2-N-(2,2,6,6-tetramethylpiperidin-4-yl)-4-N-(2,4,4-trimethylpentan-2-yl)-1,3,5-triazine-2,4-diamine?

The InChIKey is AICBGZARVAYBIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C39H76N8.C26H36O4.C21H26O3.C19H30O3.C17H18ClN3O.C17H31NO5/c1-29-40-32(43-39(13,14)28-34(2,3)4)42-33(41-29)47(31-26-37(9,10)45-38(11,12)27-31)23-21-19-17-16-18-20-22-46(15)30-24-35(5,6)44-36(7,8)25-30;1-9-30-23(29)16-26(8,17-10-12-21(27)19(14-17)24(2,3)4)18-11-13-22(28)20(15-18)25(5,6)7;1-2-3-4-5-6-10-15-24-18-13-14-19(20(22)16-18)21(23)17-11-8-7-9-12-17;1-8-22-16(20)10-9-13-11-14(18(2,3)4)17(21)15(12-13)19(5,6)7;1-10-7-12(17(2,3)4)16(22)15(8-10)21-19-13-6-5-11(18)9-14(13)20-21;1-16(2)11-13(21-5)12-17(3,4)18(16)9-10-23-15(20)8-7-14(19)22-6/h30-31,44-45H,16-28H2,1-15H3,(H,40,41,42,43);10-15,27-28H,9,16H2,1-8H3;7-9,11-14,16,22H,2-6,10,15H2,1H3;11-12,21H,8-10H2,1-7H3;5-9,22H,1-4H3;13H,7-12H2,1-6H3.

What are the key properties of 2-tert-butyl-6-(5-chlorobenzotriazol-2-yl)-4-methylphenol;ethyl 3,3-bis(3-tert-butyl-4-hydroxyphenyl)butanoate;ethyl 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoate;(2-hydroxy-4-octoxyphenyl)-phenylmethanone;4-O-[2-(4-methoxy-2,2,6,6-tetramethylpiperidin-1-yl)ethyl] 1-O-methyl butanedioate;6-methyl-2-N-[8-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]octyl]-2-N-(2,2,6,6-tetramethylpiperidin-4-yl)-4-N-(2,4,4-trimethylpentan-2-yl)-1,3,5-triazine-2,4-diamine?

2-tert-butyl-6-(5-chlorobenzotriazol-2-yl)-4-methylphenol;ethyl 3,3-bis(3-tert-butyl-4-hydroxyphenyl)butanoate;ethyl 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoate;(2-hydroxy-4-octoxyphenyl)-phenylmethanone;4-O-[2-(4-methoxy-2,2,6,6-tetramethylpiperidin-1-yl)ethyl] 1-O-methyl butanedioate;6-methyl-2-N-[8-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]octyl]-2-N-(2,2,6,6-tetramethylpiperidin-4-yl)-4-N-(2,4,4-trimethylpentan-2-yl)-1,3,5-triazine-2,4-diamine has a molecular weight of 2347.79 g/mol, XLogP of 30.84, 42 rotatable bonds, 8 hydrogen bond donors, and 28 hydrogen bond acceptors.

Where does this data come from?

All data for 2-tert-butyl-6-(5-chlorobenzotriazol-2-yl)-4-methylphenol;ethyl 3,3-bis(3-tert-butyl-4-hydroxyphenyl)butanoate;ethyl 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoate;(2-hydroxy-4-octoxyphenyl)-phenylmethanone;4-O-[2-(4-methoxy-2,2,6,6-tetramethylpiperidin-1-yl)ethyl] 1-O-methyl butanedioate;6-methyl-2-N-[8-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]octyl]-2-N-(2,2,6,6-tetramethylpiperidin-4-yl)-4-N-(2,4,4-trimethylpentan-2-yl)-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 157122147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).