[3-ditert-butylphosphanyl-4-methoxy-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]methanol;dicyclohexyl-[2-(2,6-dimethylphenyl)phenyl]phosphane;dicyclohexyl-[2-(2-methoxy-6-methylphenyl)phenyl]phosphane;[3-dicyclohexylphosphanyl-4-methyl-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]methanol;[2-(2-dicyclohexylphosphanylphenyl)-3-methylphenyl]methanol;1-methoxy-2,4-dimethyl-3-[2,4,6-tri(propan-2-yl)phenyl]benzene;[4-methoxy-3-methyl-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]methanol;1,2,3,4,5-pentamethyl-6-[2,4,6-tri(propan-2-yl)phenyl]benzene;sulfur trioxide

C218H313O11P5S — CID 161428475

About [3-ditert-butylphosphanyl-4-methoxy-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]methanol;dicyclohexyl-[2-(2,6-dimethylphenyl)phenyl]phosphane;dicyclohexyl-[2-(2-methoxy-6-methylphenyl)phenyl]phosphane;[3-dicyclohexylphosphanyl-4-methyl-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]methanol;[2-(2-dicyclohexylphosphanylphenyl)-3-methylphenyl]methanol;1-methoxy-2,4-dimethyl-3-[2,4,6-tri(propan-2-yl)phenyl]benzene;[4-methoxy-3-methyl-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]methanol;1,2,3,4,5-pentamethyl-6-[2,4,6-tri(propan-2-yl)phenyl]benzene;sulfur trioxide

[3-ditert-butylphosphanyl-4-methoxy-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]methanol;dicyclohexyl-[2-(2,6-dimethylphenyl)phenyl]phosphane;dicyclohexyl-[2-(2-methoxy-6-methylphenyl)phenyl]phosphane;[3-dicyclohexylphosphanyl-4-methyl-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]methanol;[2-(2-dicyclohexylphosphanylphenyl)-3-methylphenyl]methanol;1-methoxy-2,4-dimethyl-3-[2,4,6-tri(propan-2-yl)phenyl]benzene;[4-methoxy-3-methyl-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]methanol;1,2,3,4,5-pentamethyl-6-[2,4,6-tri(propan-2-yl)phenyl]benzene;sulfur trioxide (PubChem CID 161428475) has the molecular formula C218H313O11P5S and a molecular weight of 3296.83 g/mol. Its IUPAC name is [3-ditert-butylphosphanyl-4-methoxy-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]methanol;dicyclohexyl-[2-(2,6-dimethylphenyl)phenyl]phosphane;dicyclohexyl-[2-(2-methoxy-6-methylphenyl)phenyl]phosphane;[3-dicyclohexylphosphanyl-4-methyl-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]methanol;[2-(2-dicyclohexylphosphanylphenyl)-3-methylphenyl]methanol;1-methoxy-2,4-dimethyl-3-[2,4,6-tri(propan-2-yl)phenyl]benzene;[4-methoxy-3-methyl-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]methanol;1,2,3,4,5-pentamethyl-6-[2,4,6-tri(propan-2-yl)phenyl]benzene;sulfur trioxide.

Molecular Properties

• Compound Name: [3-ditert-butylphosphanyl-4-methoxy-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]methanol;dicyclohexyl-[2-(2,6-dimethylphenyl)phenyl]phosphane;dicyclohexyl-[2-(2-methoxy-6-methylphenyl)phenyl]phosphane;[3-dicyclohexylphosphanyl-4-methyl-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]methanol;[2-(2-dicyclohexylphosphanylphenyl)-3-methylphenyl]methanol;1-methoxy-2,4-dimethyl-3-[2,4,6-tri(propan-2-yl)phenyl]benzene;[4-methoxy-3-methyl-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]methanol;1,2,3,4,5-pentamethyl-6-[2,4,6-tri(propan-2-yl)phenyl]benzene;sulfur trioxide
• PubChem CID: 161428475
• Molecular Formula: C218H313O11P5S
• Molecular Weight: 3296.83 g/mol
• Exact Mass: 3294.23
• IUPAC Name: [3-ditert-butylphosphanyl-4-methoxy-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]methanol;dicyclohexyl-[2-(2,6-dimethylphenyl)phenyl]phosphane;dicyclohexyl-[2-(2-methoxy-6-methylphenyl)phenyl]phosphane;[3-dicyclohexylphosphanyl-4-methyl-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]methanol;[2-(2-dicyclohexylphosphanylphenyl)-3-methylphenyl]methanol;1-methoxy-2,4-dimethyl-3-[2,4,6-tri(propan-2-yl)phenyl]benzene;[4-methoxy-3-methyl-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]methanol;1,2,3,4,5-pentamethyl-6-[2,4,6-tri(propan-2-yl)phenyl]benzene;sulfur trioxide
• SMILES: COc1ccc(C)c(-c2c(C(C)C)cc(C(C)C)cc2C(C)C)c1C.COc1ccc(CO)c(-c2c(C(C)C)cc(C(C)C)cc2C(C)C)c1C.COc1ccc(CO)c(-c2c(C(C)C)cc(C(C)C)cc2C(C)C)c1P(C(C)(C)C)C(C)(C)C.COc1cccc(C)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1c(C)c(C)c(-c2c(C(C)C)cc(C(C)C)cc2C(C)C)c(C)c1C.Cc1ccc(CO)c(-c2c(C(C)C)cc(C(C)C)cc2C(C)C)c1P(C1CCCCC1)C1CCCCC1.Cc1cccc(C)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1cccc(CO)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.O=S(=O)=O
• InChI: InChI=1S/C35H53OP.C31H49O2P.2C26H35OP.C26H35P.C26H38.C24H34O2.C24H34O.O3S/c1-23(2)28-20-31(24(3)4)34(32(21-28)25(5)6)33-27(22-36)19-18-26(7)35(33)37(29-14-10-8-11-15-29)30-16-12-9-13-17-30;1-19(2)23-16-24(20(3)4)28(25(17-23)21(5)6)27-22(18-32)14-15-26(33-13)29(27)34(30(7,8)9)31(10,11)12;1-20-12-11-18-24(27-2)26(20)23-17-9-10-19-25(23)28(21-13-5-3-6-14-21)22-15-7-4-8-16-22;1-20-11-10-12-21(19-27)26(20)24-17-8-9-18-25(24)28(22-13-4-2-5-14-22)23-15-6-3-7-16-23;1-20-12-11-13-21(2)26(20)24-18-9-10-19-25(24)27(22-14-5-3-6-15-22)23-16-7-4-8-17-23;1-14(2)22-12-23(15(3)4)26(24(13-22)16(5)6)25-20(10)18(8)17(7)19(9)21(25)11;1-14(2)19-11-20(15(3)4)24(21(12-19)16(5)6)23-17(7)22(26-8)10-9-18(23)13-25;1-14(2)19-12-20(15(3)4)24(21(13-19)16(5)6)23-17(7)10-11-22(25-9)18(23)8;1-4(2)3/h18-21,23-25,29-30,36H,8-17,22H2,1-7H3;14-17,19-21,32H,18H2,1-13H3;9-12,17-19,21-22H,3-8,13-16H2,1-2H3;8-12,17-18,22-23,27H,2-7,13-16,19H2,1H3;9-13,18-19,22-23H,3-8,14-17H2,1-2H3;12-16H,1-11H3;9-12,14-16,25H,13H2,1-8H3;10-16H,1-9H3
• InChIKey: VXROBCVBLVTCJQ-UHFFFAOYSA-N
• XLogP: 62.48
• TPSA: 169.05 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 11
• Rotatable Bonds: 44
• Heavy Atoms: 235
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3296.83
LogP ≤ 5	62.48
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	11

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of [3-ditert-butylphosphanyl-4-methoxy-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]methanol;dicyclohexyl-[2-(2,6-dimethylphenyl)phenyl]phosphane;dicyclohexyl-[2-(2-methoxy-6-methylphenyl)phenyl]phosphane;[3-dicyclohexylphosphanyl-4-methyl-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]methanol;[2-(2-dicyclohexylphosphanylphenyl)-3-methylphenyl]methanol;1-methoxy-2,4-dimethyl-3-[2,4,6-tri(propan-2-yl)phenyl]benzene;[4-methoxy-3-methyl-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]methanol;1,2,3,4,5-pentamethyl-6-[2,4,6-tri(propan-2-yl)phenyl]benzene;sulfur trioxide?

The IUPAC name of [3-ditert-butylphosphanyl-4-methoxy-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]methanol;dicyclohexyl-[2-(2,6-dimethylphenyl)phenyl]phosphane;dicyclohexyl-[2-(2-methoxy-6-methylphenyl)phenyl]phosphane;[3-dicyclohexylphosphanyl-4-methyl-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]methanol;[2-(2-dicyclohexylphosphanylphenyl)-3-methylphenyl]methanol;1-methoxy-2,4-dimethyl-3-[2,4,6-tri(propan-2-yl)phenyl]benzene;[4-methoxy-3-methyl-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]methanol;1,2,3,4,5-pentamethyl-6-[2,4,6-tri(propan-2-yl)phenyl]benzene;sulfur trioxide (CID 161428475) is [3-ditert-butylphosphanyl-4-methoxy-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]methanol;dicyclohexyl-[2-(2,6-dimethylphenyl)phenyl]phosphane;dicyclohexyl-[2-(2-methoxy-6-methylphenyl)phenyl]phosphane;[3-dicyclohexylphosphanyl-4-methyl-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]methanol;[2-(2-dicyclohexylphosphanylphenyl)-3-methylphenyl]methanol;1-methoxy-2,4-dimethyl-3-[2,4,6-tri(propan-2-yl)phenyl]benzene;[4-methoxy-3-methyl-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]methanol;1,2,3,4,5-pentamethyl-6-[2,4,6-tri(propan-2-yl)phenyl]benzene;sulfur trioxide.

What is the SMILES notation for [3-ditert-butylphosphanyl-4-methoxy-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]methanol;dicyclohexyl-[2-(2,6-dimethylphenyl)phenyl]phosphane;dicyclohexyl-[2-(2-methoxy-6-methylphenyl)phenyl]phosphane;[3-dicyclohexylphosphanyl-4-methyl-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]methanol;[2-(2-dicyclohexylphosphanylphenyl)-3-methylphenyl]methanol;1-methoxy-2,4-dimethyl-3-[2,4,6-tri(propan-2-yl)phenyl]benzene;[4-methoxy-3-methyl-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]methanol;1,2,3,4,5-pentamethyl-6-[2,4,6-tri(propan-2-yl)phenyl]benzene;sulfur trioxide?

The canonical SMILES for [3-ditert-butylphosphanyl-4-methoxy-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]methanol;dicyclohexyl-[2-(2,6-dimethylphenyl)phenyl]phosphane;dicyclohexyl-[2-(2-methoxy-6-methylphenyl)phenyl]phosphane;[3-dicyclohexylphosphanyl-4-methyl-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]methanol;[2-(2-dicyclohexylphosphanylphenyl)-3-methylphenyl]methanol;1-methoxy-2,4-dimethyl-3-[2,4,6-tri(propan-2-yl)phenyl]benzene;[4-methoxy-3-methyl-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]methanol;1,2,3,4,5-pentamethyl-6-[2,4,6-tri(propan-2-yl)phenyl]benzene;sulfur trioxide is COc1ccc(C)c(-c2c(C(C)C)cc(C(C)C)cc2C(C)C)c1C.COc1ccc(CO)c(-c2c(C(C)C)cc(C(C)C)cc2C(C)C)c1C.COc1ccc(CO)c(-c2c(C(C)C)cc(C(C)C)cc2C(C)C)c1P(C(C)(C)C)C(C)(C)C.COc1cccc(C)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1c(C)c(C)c(-c2c(C(C)C)cc(C(C)C)cc2C(C)C)c(C)c1C.Cc1ccc(CO)c(-c2c(C(C)C)cc(C(C)C)cc2C(C)C)c1P(C1CCCCC1)C1CCCCC1.Cc1cccc(C)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1cccc(CO)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.O=S(=O)=O.

What is the InChIKey of [3-ditert-butylphosphanyl-4-methoxy-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]methanol;dicyclohexyl-[2-(2,6-dimethylphenyl)phenyl]phosphane;dicyclohexyl-[2-(2-methoxy-6-methylphenyl)phenyl]phosphane;[3-dicyclohexylphosphanyl-4-methyl-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]methanol;[2-(2-dicyclohexylphosphanylphenyl)-3-methylphenyl]methanol;1-methoxy-2,4-dimethyl-3-[2,4,6-tri(propan-2-yl)phenyl]benzene;[4-methoxy-3-methyl-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]methanol;1,2,3,4,5-pentamethyl-6-[2,4,6-tri(propan-2-yl)phenyl]benzene;sulfur trioxide?

The InChIKey is VXROBCVBLVTCJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H53OP.C31H49O2P.2C26H35OP.C26H35P.C26H38.C24H34O2.C24H34O.O3S/c1-23(2)28-20-31(24(3)4)34(32(21-28)25(5)6)33-27(22-36)19-18-26(7)35(33)37(29-14-10-8-11-15-29)30-16-12-9-13-17-30;1-19(2)23-16-24(20(3)4)28(25(17-23)21(5)6)27-22(18-32)14-15-26(33-13)29(27)34(30(7,8)9)31(10,11)12;1-20-12-11-18-24(27-2)26(20)23-17-9-10-19-25(23)28(21-13-5-3-6-14-21)22-15-7-4-8-16-22;1-20-11-10-12-21(19-27)26(20)24-17-8-9-18-25(24)28(22-13-4-2-5-14-22)23-15-6-3-7-16-23;1-20-12-11-13-21(2)26(20)24-18-9-10-19-25(24)27(22-14-5-3-6-15-22)23-16-7-4-8-17-23;1-14(2)22-12-23(15(3)4)26(24(13-22)16(5)6)25-20(10)18(8)17(7)19(9)21(25)11;1-14(2)19-11-20(15(3)4)24(21(12-19)16(5)6)23-17(7)22(26-8)10-9-18(23)13-25;1-14(2)19-12-20(15(3)4)24(21(13-19)16(5)6)23-17(7)10-11-22(25-9)18(23)8;1-4(2)3/h18-21,23-25,29-30,36H,8-17,22H2,1-7H3;14-17,19-21,32H,18H2,1-13H3;9-12,17-19,21-22H,3-8,13-16H2,1-2H3;8-12,17-18,22-23,27H,2-7,13-16,19H2,1H3;9-13,18-19,22-23H,3-8,14-17H2,1-2H3;12-16H,1-11H3;9-12,14-16,25H,13H2,1-8H3;10-16H,1-9H3;.

What are the key properties of [3-ditert-butylphosphanyl-4-methoxy-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]methanol;dicyclohexyl-[2-(2,6-dimethylphenyl)phenyl]phosphane;dicyclohexyl-[2-(2-methoxy-6-methylphenyl)phenyl]phosphane;[3-dicyclohexylphosphanyl-4-methyl-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]methanol;[2-(2-dicyclohexylphosphanylphenyl)-3-methylphenyl]methanol;1-methoxy-2,4-dimethyl-3-[2,4,6-tri(propan-2-yl)phenyl]benzene;[4-methoxy-3-methyl-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]methanol;1,2,3,4,5-pentamethyl-6-[2,4,6-tri(propan-2-yl)phenyl]benzene;sulfur trioxide?

[3-ditert-butylphosphanyl-4-methoxy-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]methanol;dicyclohexyl-[2-(2,6-dimethylphenyl)phenyl]phosphane;dicyclohexyl-[2-(2-methoxy-6-methylphenyl)phenyl]phosphane;[3-dicyclohexylphosphanyl-4-methyl-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]methanol;[2-(2-dicyclohexylphosphanylphenyl)-3-methylphenyl]methanol;1-methoxy-2,4-dimethyl-3-[2,4,6-tri(propan-2-yl)phenyl]benzene;[4-methoxy-3-methyl-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]methanol;1,2,3,4,5-pentamethyl-6-[2,4,6-tri(propan-2-yl)phenyl]benzene;sulfur trioxide has a molecular weight of 3296.83 g/mol, XLogP of 62.48, 44 rotatable bonds, 4 hydrogen bond donors, and 11 hydrogen bond acceptors.

Where does this data come from?

All data for [3-ditert-butylphosphanyl-4-methoxy-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]methanol;dicyclohexyl-[2-(2,6-dimethylphenyl)phenyl]phosphane;dicyclohexyl-[2-(2-methoxy-6-methylphenyl)phenyl]phosphane;[3-dicyclohexylphosphanyl-4-methyl-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]methanol;[2-(2-dicyclohexylphosphanylphenyl)-3-methylphenyl]methanol;1-methoxy-2,4-dimethyl-3-[2,4,6-tri(propan-2-yl)phenyl]benzene;[4-methoxy-3-methyl-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]methanol;1,2,3,4,5-pentamethyl-6-[2,4,6-tri(propan-2-yl)phenyl]benzene;sulfur trioxide is sourced from PubChem (CID 161428475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).