2-(benzotriazol-2-yl)-6-[[3-(benzotriazol-2-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]methyl]-4-(2,4,4-trimethylpentan-2-yl)phenol;2-tert-butyl-4-(5-tert-butyl-2,4-dimethylphenyl)sulfanyl-5-methylphenol;2,4-ditert-butyl-6-[1-(3,5-ditert-butyl-2-hydroxyphenyl)ethyl]phenol;(2,4-ditert-butylphenyl) 3,5-ditert-butyl-4-hydroxybenzoate

C123H170N6O8S — CID 159314505

About 2-(benzotriazol-2-yl)-6-[[3-(benzotriazol-2-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]methyl]-4-(2,4,4-trimethylpentan-2-yl)phenol;2-tert-butyl-4-(5-tert-butyl-2,4-dimethylphenyl)sulfanyl-5-methylphenol;2,4-ditert-butyl-6-[1-(3,5-ditert-butyl-2-hydroxyphenyl)ethyl]phenol;(2,4-ditert-butylphenyl) 3,5-ditert-butyl-4-hydroxybenzoate

2-(benzotriazol-2-yl)-6-[[3-(benzotriazol-2-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]methyl]-4-(2,4,4-trimethylpentan-2-yl)phenol;2-tert-butyl-4-(5-tert-butyl-2,4-dimethylphenyl)sulfanyl-5-methylphenol;2,4-ditert-butyl-6-[1-(3,5-ditert-butyl-2-hydroxyphenyl)ethyl]phenol;(2,4-ditert-butylphenyl) 3,5-ditert-butyl-4-hydroxybenzoate (PubChem CID 159314505) has the molecular formula C123H170N6O8S and a molecular weight of 1892.81 g/mol. Its IUPAC name is 2-(benzotriazol-2-yl)-6-[[3-(benzotriazol-2-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]methyl]-4-(2,4,4-trimethylpentan-2-yl)phenol;2-tert-butyl-4-(5-tert-butyl-2,4-dimethylphenyl)sulfanyl-5-methylphenol;2,4-ditert-butyl-6-[1-(3,5-ditert-butyl-2-hydroxyphenyl)ethyl]phenol;(2,4-ditert-butylphenyl) 3,5-ditert-butyl-4-hydroxybenzoate.

Molecular Properties

• Compound Name: 2-(benzotriazol-2-yl)-6-[[3-(benzotriazol-2-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]methyl]-4-(2,4,4-trimethylpentan-2-yl)phenol;2-tert-butyl-4-(5-tert-butyl-2,4-dimethylphenyl)sulfanyl-5-methylphenol;2,4-ditert-butyl-6-[1-(3,5-ditert-butyl-2-hydroxyphenyl)ethyl]phenol;(2,4-ditert-butylphenyl) 3,5-ditert-butyl-4-hydroxybenzoate
• PubChem CID: 159314505
• Molecular Formula: C123H170N6O8S
• Molecular Weight: 1892.81 g/mol
• Exact Mass: 1891.28
• IUPAC Name: 2-(benzotriazol-2-yl)-6-[[3-(benzotriazol-2-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]methyl]-4-(2,4,4-trimethylpentan-2-yl)phenol;2-tert-butyl-4-(5-tert-butyl-2,4-dimethylphenyl)sulfanyl-5-methylphenol;2,4-ditert-butyl-6-[1-(3,5-ditert-butyl-2-hydroxyphenyl)ethyl]phenol;(2,4-ditert-butylphenyl) 3,5-ditert-butyl-4-hydroxybenzoate
• SMILES: CC(C)(C)CC(C)(C)c1cc(Cc2cc(C(C)(C)CC(C)(C)C)cc(-n3nc4ccccc4n3)c2O)c(O)c(-n2nc3ccccc3n2)c1.CC(C)(C)c1ccc(OC(=O)c2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)c(C(C)(C)C)c1.CC(c1cc(C(C)(C)C)cc(C(C)(C)C)c1O)c1cc(C(C)(C)C)cc(C(C)(C)C)c1O.Cc1cc(C)c(C(C)(C)C)cc1Sc1cc(C(C)(C)C)c(O)cc1C
• InChI: InChI=1S/C41H50N6O2.C30H46O2.C29H42O3.C23H32OS/c1-38(2,3)24-40(7,8)28-20-26(36(48)34(22-28)46-42-30-15-11-12-16-31(30)43-46)19-27-21-29(41(9,10)25-39(4,5)6)23-35(37(27)49)47-44-32-17-13-14-18-33(32)45-47;1-18(21-14-19(27(2,3)4)16-23(25(21)31)29(8,9)10)22-15-20(28(5,6)7)17-24(26(22)32)30(11,12)13;1-26(2,3)19-13-14-23(20(17-19)27(4,5)6)32-25(31)18-15-21(28(7,8)9)24(30)22(16-18)29(10,11)12;1-14-10-15(2)20(12-17(14)22(4,5)6)25-21-13-18(23(7,8)9)19(24)11-16(21)3/h11-18,20-23,48-49H,19,24-25H2,1-10H3;14-18,31-32H,1-13H3;13-17,30H,1-12H3;10-13,24H,1-9H3
• InChIKey: LCYTWWXFTALOQX-UHFFFAOYSA-N
• XLogP: 32.89
• TPSA: 209.10 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 15
• Rotatable Bonds: 14
• Heavy Atoms: 138
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1892.81
LogP ≤ 5	32.89
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	15

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'phenol_ester', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-(benzotriazol-2-yl)-6-[[3-(benzotriazol-2-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]methyl]-4-(2,4,4-trimethylpentan-2-yl)phenol;2-tert-butyl-4-(5-tert-butyl-2,4-dimethylphenyl)sulfanyl-5-methylphenol;2,4-ditert-butyl-6-[1-(3,5-ditert-butyl-2-hydroxyphenyl)ethyl]phenol;(2,4-ditert-butylphenyl) 3,5-ditert-butyl-4-hydroxybenzoate?

The IUPAC name of 2-(benzotriazol-2-yl)-6-[[3-(benzotriazol-2-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]methyl]-4-(2,4,4-trimethylpentan-2-yl)phenol;2-tert-butyl-4-(5-tert-butyl-2,4-dimethylphenyl)sulfanyl-5-methylphenol;2,4-ditert-butyl-6-[1-(3,5-ditert-butyl-2-hydroxyphenyl)ethyl]phenol;(2,4-ditert-butylphenyl) 3,5-ditert-butyl-4-hydroxybenzoate (CID 159314505) is 2-(benzotriazol-2-yl)-6-[[3-(benzotriazol-2-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]methyl]-4-(2,4,4-trimethylpentan-2-yl)phenol;2-tert-butyl-4-(5-tert-butyl-2,4-dimethylphenyl)sulfanyl-5-methylphenol;2,4-ditert-butyl-6-[1-(3,5-ditert-butyl-2-hydroxyphenyl)ethyl]phenol;(2,4-ditert-butylphenyl) 3,5-ditert-butyl-4-hydroxybenzoate.

What is the SMILES notation for 2-(benzotriazol-2-yl)-6-[[3-(benzotriazol-2-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]methyl]-4-(2,4,4-trimethylpentan-2-yl)phenol;2-tert-butyl-4-(5-tert-butyl-2,4-dimethylphenyl)sulfanyl-5-methylphenol;2,4-ditert-butyl-6-[1-(3,5-ditert-butyl-2-hydroxyphenyl)ethyl]phenol;(2,4-ditert-butylphenyl) 3,5-ditert-butyl-4-hydroxybenzoate?

The canonical SMILES for 2-(benzotriazol-2-yl)-6-[[3-(benzotriazol-2-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]methyl]-4-(2,4,4-trimethylpentan-2-yl)phenol;2-tert-butyl-4-(5-tert-butyl-2,4-dimethylphenyl)sulfanyl-5-methylphenol;2,4-ditert-butyl-6-[1-(3,5-ditert-butyl-2-hydroxyphenyl)ethyl]phenol;(2,4-ditert-butylphenyl) 3,5-ditert-butyl-4-hydroxybenzoate is CC(C)(C)CC(C)(C)c1cc(Cc2cc(C(C)(C)CC(C)(C)C)cc(-n3nc4ccccc4n3)c2O)c(O)c(-n2nc3ccccc3n2)c1.CC(C)(C)c1ccc(OC(=O)c2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)c(C(C)(C)C)c1.CC(c1cc(C(C)(C)C)cc(C(C)(C)C)c1O)c1cc(C(C)(C)C)cc(C(C)(C)C)c1O.Cc1cc(C)c(C(C)(C)C)cc1Sc1cc(C(C)(C)C)c(O)cc1C.

What is the InChIKey of 2-(benzotriazol-2-yl)-6-[[3-(benzotriazol-2-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]methyl]-4-(2,4,4-trimethylpentan-2-yl)phenol;2-tert-butyl-4-(5-tert-butyl-2,4-dimethylphenyl)sulfanyl-5-methylphenol;2,4-ditert-butyl-6-[1-(3,5-ditert-butyl-2-hydroxyphenyl)ethyl]phenol;(2,4-ditert-butylphenyl) 3,5-ditert-butyl-4-hydroxybenzoate?

The InChIKey is LCYTWWXFTALOQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C41H50N6O2.C30H46O2.C29H42O3.C23H32OS/c1-38(2,3)24-40(7,8)28-20-26(36(48)34(22-28)46-42-30-15-11-12-16-31(30)43-46)19-27-21-29(41(9,10)25-39(4,5)6)23-35(37(27)49)47-44-32-17-13-14-18-33(32)45-47;1-18(21-14-19(27(2,3)4)16-23(25(21)31)29(8,9)10)22-15-20(28(5,6)7)17-24(26(22)32)30(11,12)13;1-26(2,3)19-13-14-23(20(17-19)27(4,5)6)32-25(31)18-15-21(28(7,8)9)24(30)22(16-18)29(10,11)12;1-14-10-15(2)20(12-17(14)22(4,5)6)25-21-13-18(23(7,8)9)19(24)11-16(21)3/h11-18,20-23,48-49H,19,24-25H2,1-10H3;14-18,31-32H,1-13H3;13-17,30H,1-12H3;10-13,24H,1-9H3.

What are the key properties of 2-(benzotriazol-2-yl)-6-[[3-(benzotriazol-2-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]methyl]-4-(2,4,4-trimethylpentan-2-yl)phenol;2-tert-butyl-4-(5-tert-butyl-2,4-dimethylphenyl)sulfanyl-5-methylphenol;2,4-ditert-butyl-6-[1-(3,5-ditert-butyl-2-hydroxyphenyl)ethyl]phenol;(2,4-ditert-butylphenyl) 3,5-ditert-butyl-4-hydroxybenzoate?

2-(benzotriazol-2-yl)-6-[[3-(benzotriazol-2-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]methyl]-4-(2,4,4-trimethylpentan-2-yl)phenol;2-tert-butyl-4-(5-tert-butyl-2,4-dimethylphenyl)sulfanyl-5-methylphenol;2,4-ditert-butyl-6-[1-(3,5-ditert-butyl-2-hydroxyphenyl)ethyl]phenol;(2,4-ditert-butylphenyl) 3,5-ditert-butyl-4-hydroxybenzoate has a molecular weight of 1892.81 g/mol, XLogP of 32.89, 14 rotatable bonds, 6 hydrogen bond donors, and 15 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(benzotriazol-2-yl)-6-[[3-(benzotriazol-2-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]methyl]-4-(2,4,4-trimethylpentan-2-yl)phenol;2-tert-butyl-4-(5-tert-butyl-2,4-dimethylphenyl)sulfanyl-5-methylphenol;2,4-ditert-butyl-6-[1-(3,5-ditert-butyl-2-hydroxyphenyl)ethyl]phenol;(2,4-ditert-butylphenyl) 3,5-ditert-butyl-4-hydroxybenzoate is sourced from PubChem (CID 159314505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).