[3-(2-diphenylphosphanyl-1-benzothiophen-3-yl)-1-benzothiophen-2-yl]-diphenylphosphane;[2-(2-diphenylphosphanyl-4-methoxy-5,6-dimethyl-3-phenylphenyl)-5-methoxy-3,4-dimethyl-6-phenylphenyl]-diphenylphosphane;[3-(4-diphenylphosphanyl-6-methoxy-2-methyl-3-pyridinyl)-6-methoxy-2-methyl-4-pyridinyl]-diphenylphosphane;[1-(2-diphenylphosphanyl-6-methylphenyl)naphthalen-2-yl]-diphenylphosphane;2,3,5-trimethyl-4-(2,4,5-trimethylthiophen-3-yl)thiophene

C187H160N2O4P8S4 — CID 158566636

About [3-(2-diphenylphosphanyl-1-benzothiophen-3-yl)-1-benzothiophen-2-yl]-diphenylphosphane;[2-(2-diphenylphosphanyl-4-methoxy-5,6-dimethyl-3-phenylphenyl)-5-methoxy-3,4-dimethyl-6-phenylphenyl]-diphenylphosphane;[3-(4-diphenylphosphanyl-6-methoxy-2-methyl-3-pyridinyl)-6-methoxy-2-methyl-4-pyridinyl]-diphenylphosphane;[1-(2-diphenylphosphanyl-6-methylphenyl)naphthalen-2-yl]-diphenylphosphane;2,3,5-trimethyl-4-(2,4,5-trimethylthiophen-3-yl)thiophene

[3-(2-diphenylphosphanyl-1-benzothiophen-3-yl)-1-benzothiophen-2-yl]-diphenylphosphane;[2-(2-diphenylphosphanyl-4-methoxy-5,6-dimethyl-3-phenylphenyl)-5-methoxy-3,4-dimethyl-6-phenylphenyl]-diphenylphosphane;[3-(4-diphenylphosphanyl-6-methoxy-2-methyl-3-pyridinyl)-6-methoxy-2-methyl-4-pyridinyl]-diphenylphosphane;[1-(2-diphenylphosphanyl-6-methylphenyl)naphthalen-2-yl]-diphenylphosphane;2,3,5-trimethyl-4-(2,4,5-trimethylthiophen-3-yl)thiophene (PubChem CID 158566636) has the molecular formula C187H160N2O4P8S4 and a molecular weight of 2875.41 g/mol. Its IUPAC name is [3-(2-diphenylphosphanyl-1-benzothiophen-3-yl)-1-benzothiophen-2-yl]-diphenylphosphane;[2-(2-diphenylphosphanyl-4-methoxy-5,6-dimethyl-3-phenylphenyl)-5-methoxy-3,4-dimethyl-6-phenylphenyl]-diphenylphosphane;[3-(4-diphenylphosphanyl-6-methoxy-2-methyl-3-pyridinyl)-6-methoxy-2-methyl-4-pyridinyl]-diphenylphosphane;[1-(2-diphenylphosphanyl-6-methylphenyl)naphthalen-2-yl]-diphenylphosphane;2,3,5-trimethyl-4-(2,4,5-trimethylthiophen-3-yl)thiophene.

Molecular Properties

• Compound Name: [3-(2-diphenylphosphanyl-1-benzothiophen-3-yl)-1-benzothiophen-2-yl]-diphenylphosphane;[2-(2-diphenylphosphanyl-4-methoxy-5,6-dimethyl-3-phenylphenyl)-5-methoxy-3,4-dimethyl-6-phenylphenyl]-diphenylphosphane;[3-(4-diphenylphosphanyl-6-methoxy-2-methyl-3-pyridinyl)-6-methoxy-2-methyl-4-pyridinyl]-diphenylphosphane;[1-(2-diphenylphosphanyl-6-methylphenyl)naphthalen-2-yl]-diphenylphosphane;2,3,5-trimethyl-4-(2,4,5-trimethylthiophen-3-yl)thiophene
• PubChem CID: 158566636
• Molecular Formula: C187H160N2O4P8S4
• Molecular Weight: 2875.41 g/mol
• Exact Mass: 2872.92
• IUPAC Name: [3-(2-diphenylphosphanyl-1-benzothiophen-3-yl)-1-benzothiophen-2-yl]-diphenylphosphane;[2-(2-diphenylphosphanyl-4-methoxy-5,6-dimethyl-3-phenylphenyl)-5-methoxy-3,4-dimethyl-6-phenylphenyl]-diphenylphosphane;[3-(4-diphenylphosphanyl-6-methoxy-2-methyl-3-pyridinyl)-6-methoxy-2-methyl-4-pyridinyl]-diphenylphosphane;[1-(2-diphenylphosphanyl-6-methylphenyl)naphthalen-2-yl]-diphenylphosphane;2,3,5-trimethyl-4-(2,4,5-trimethylthiophen-3-yl)thiophene
• SMILES: COc1c(C)c(C)c(-c2c(C)c(C)c(OC)c(-c3ccccc3)c2P(c2ccccc2)c2ccccc2)c(P(c2ccccc2)c2ccccc2)c1-c1ccccc1.COc1cc(P(c2ccccc2)c2ccccc2)c(-c2c(P(c3ccccc3)c3ccccc3)cc(OC)nc2C)c(C)n1.Cc1cccc(P(c2ccccc2)c2ccccc2)c1-c1c(P(c2ccccc2)c2ccccc2)ccc2ccccc12.Cc1sc(C)c(-c2c(C)sc(C)c2C)c1C.c1ccc(P(c2ccccc2)c2sc3ccccc3c2-c2c(P(c3ccccc3)c3ccccc3)sc3ccccc23)cc1
• InChI: InChI=1S/C54H48O2P2.C41H32P2.C40H28P2S2.C38H34N2O2P2.C14H18S2/c1-37-39(3)51(55-5)49(41-25-13-7-14-26-41)53(57(43-29-17-9-18-30-43)44-31-19-10-20-32-44)47(37)48-38(2)40(4)52(56-6)50(42-27-15-8-16-28-42)54(48)58(45-33-21-11-22-34-45)46-35-23-12-24-36-46;1-31-17-16-28-38(42(33-19-6-2-7-20-33)34-21-8-3-9-22-34)40(31)41-37-27-15-14-18-32(37)29-30-39(41)43(35-23-10-4-11-24-35)36-25-12-5-13-26-36;1-5-17-29(18-6-1)41(30-19-7-2-8-20-30)39-37(33-25-13-15-27-35(33)43-39)38-34-26-14-16-28-36(34)44-40(38)42(31-21-9-3-10-22-31)32-23-11-4-12-24-32;1-27-37(33(25-35(39-27)41-3)43(29-17-9-5-10-18-29)30-19-11-6-12-20-30)38-28(2)40-36(42-4)26-34(38)44(31-21-13-7-14-22-31)32-23-15-8-16-24-32;1-7-9(3)15-11(5)13(7)14-8(2)10(4)16-12(14)6/h7-36H,1-6H3;2-30H,1H3;1-28H;5-26H,1-4H3;1-6H3
• InChIKey: HROGRPQZOAMNRV-UHFFFAOYSA-N
• XLogP: 40.71
• TPSA: 62.70 Ų
• H-Bond Acceptors: 10
• Rotatable Bonds: 35
• Heavy Atoms: 205
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2875.41
LogP ≤ 5	40.71
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	10

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of [3-(2-diphenylphosphanyl-1-benzothiophen-3-yl)-1-benzothiophen-2-yl]-diphenylphosphane;[2-(2-diphenylphosphanyl-4-methoxy-5,6-dimethyl-3-phenylphenyl)-5-methoxy-3,4-dimethyl-6-phenylphenyl]-diphenylphosphane;[3-(4-diphenylphosphanyl-6-methoxy-2-methyl-3-pyridinyl)-6-methoxy-2-methyl-4-pyridinyl]-diphenylphosphane;[1-(2-diphenylphosphanyl-6-methylphenyl)naphthalen-2-yl]-diphenylphosphane;2,3,5-trimethyl-4-(2,4,5-trimethylthiophen-3-yl)thiophene?

The IUPAC name of [3-(2-diphenylphosphanyl-1-benzothiophen-3-yl)-1-benzothiophen-2-yl]-diphenylphosphane;[2-(2-diphenylphosphanyl-4-methoxy-5,6-dimethyl-3-phenylphenyl)-5-methoxy-3,4-dimethyl-6-phenylphenyl]-diphenylphosphane;[3-(4-diphenylphosphanyl-6-methoxy-2-methyl-3-pyridinyl)-6-methoxy-2-methyl-4-pyridinyl]-diphenylphosphane;[1-(2-diphenylphosphanyl-6-methylphenyl)naphthalen-2-yl]-diphenylphosphane;2,3,5-trimethyl-4-(2,4,5-trimethylthiophen-3-yl)thiophene (CID 158566636) is [3-(2-diphenylphosphanyl-1-benzothiophen-3-yl)-1-benzothiophen-2-yl]-diphenylphosphane;[2-(2-diphenylphosphanyl-4-methoxy-5,6-dimethyl-3-phenylphenyl)-5-methoxy-3,4-dimethyl-6-phenylphenyl]-diphenylphosphane;[3-(4-diphenylphosphanyl-6-methoxy-2-methyl-3-pyridinyl)-6-methoxy-2-methyl-4-pyridinyl]-diphenylphosphane;[1-(2-diphenylphosphanyl-6-methylphenyl)naphthalen-2-yl]-diphenylphosphane;2,3,5-trimethyl-4-(2,4,5-trimethylthiophen-3-yl)thiophene.

What is the SMILES notation for [3-(2-diphenylphosphanyl-1-benzothiophen-3-yl)-1-benzothiophen-2-yl]-diphenylphosphane;[2-(2-diphenylphosphanyl-4-methoxy-5,6-dimethyl-3-phenylphenyl)-5-methoxy-3,4-dimethyl-6-phenylphenyl]-diphenylphosphane;[3-(4-diphenylphosphanyl-6-methoxy-2-methyl-3-pyridinyl)-6-methoxy-2-methyl-4-pyridinyl]-diphenylphosphane;[1-(2-diphenylphosphanyl-6-methylphenyl)naphthalen-2-yl]-diphenylphosphane;2,3,5-trimethyl-4-(2,4,5-trimethylthiophen-3-yl)thiophene?

The canonical SMILES for [3-(2-diphenylphosphanyl-1-benzothiophen-3-yl)-1-benzothiophen-2-yl]-diphenylphosphane;[2-(2-diphenylphosphanyl-4-methoxy-5,6-dimethyl-3-phenylphenyl)-5-methoxy-3,4-dimethyl-6-phenylphenyl]-diphenylphosphane;[3-(4-diphenylphosphanyl-6-methoxy-2-methyl-3-pyridinyl)-6-methoxy-2-methyl-4-pyridinyl]-diphenylphosphane;[1-(2-diphenylphosphanyl-6-methylphenyl)naphthalen-2-yl]-diphenylphosphane;2,3,5-trimethyl-4-(2,4,5-trimethylthiophen-3-yl)thiophene is COc1c(C)c(C)c(-c2c(C)c(C)c(OC)c(-c3ccccc3)c2P(c2ccccc2)c2ccccc2)c(P(c2ccccc2)c2ccccc2)c1-c1ccccc1.COc1cc(P(c2ccccc2)c2ccccc2)c(-c2c(P(c3ccccc3)c3ccccc3)cc(OC)nc2C)c(C)n1.Cc1cccc(P(c2ccccc2)c2ccccc2)c1-c1c(P(c2ccccc2)c2ccccc2)ccc2ccccc12.Cc1sc(C)c(-c2c(C)sc(C)c2C)c1C.c1ccc(P(c2ccccc2)c2sc3ccccc3c2-c2c(P(c3ccccc3)c3ccccc3)sc3ccccc23)cc1.

What is the InChIKey of [3-(2-diphenylphosphanyl-1-benzothiophen-3-yl)-1-benzothiophen-2-yl]-diphenylphosphane;[2-(2-diphenylphosphanyl-4-methoxy-5,6-dimethyl-3-phenylphenyl)-5-methoxy-3,4-dimethyl-6-phenylphenyl]-diphenylphosphane;[3-(4-diphenylphosphanyl-6-methoxy-2-methyl-3-pyridinyl)-6-methoxy-2-methyl-4-pyridinyl]-diphenylphosphane;[1-(2-diphenylphosphanyl-6-methylphenyl)naphthalen-2-yl]-diphenylphosphane;2,3,5-trimethyl-4-(2,4,5-trimethylthiophen-3-yl)thiophene?

The InChIKey is HROGRPQZOAMNRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H48O2P2.C41H32P2.C40H28P2S2.C38H34N2O2P2.C14H18S2/c1-37-39(3)51(55-5)49(41-25-13-7-14-26-41)53(57(43-29-17-9-18-30-43)44-31-19-10-20-32-44)47(37)48-38(2)40(4)52(56-6)50(42-27-15-8-16-28-42)54(48)58(45-33-21-11-22-34-45)46-35-23-12-24-36-46;1-31-17-16-28-38(42(33-19-6-2-7-20-33)34-21-8-3-9-22-34)40(31)41-37-27-15-14-18-32(37)29-30-39(41)43(35-23-10-4-11-24-35)36-25-12-5-13-26-36;1-5-17-29(18-6-1)41(30-19-7-2-8-20-30)39-37(33-25-13-15-27-35(33)43-39)38-34-26-14-16-28-36(34)44-40(38)42(31-21-9-3-10-22-31)32-23-11-4-12-24-32;1-27-37(33(25-35(39-27)41-3)43(29-17-9-5-10-18-29)30-19-11-6-12-20-30)38-28(2)40-36(42-4)26-34(38)44(31-21-13-7-14-22-31)32-23-15-8-16-24-32;1-7-9(3)15-11(5)13(7)14-8(2)10(4)16-12(14)6/h7-36H,1-6H3;2-30H,1H3;1-28H;5-26H,1-4H3;1-6H3.

What are the key properties of [3-(2-diphenylphosphanyl-1-benzothiophen-3-yl)-1-benzothiophen-2-yl]-diphenylphosphane;[2-(2-diphenylphosphanyl-4-methoxy-5,6-dimethyl-3-phenylphenyl)-5-methoxy-3,4-dimethyl-6-phenylphenyl]-diphenylphosphane;[3-(4-diphenylphosphanyl-6-methoxy-2-methyl-3-pyridinyl)-6-methoxy-2-methyl-4-pyridinyl]-diphenylphosphane;[1-(2-diphenylphosphanyl-6-methylphenyl)naphthalen-2-yl]-diphenylphosphane;2,3,5-trimethyl-4-(2,4,5-trimethylthiophen-3-yl)thiophene?

[3-(2-diphenylphosphanyl-1-benzothiophen-3-yl)-1-benzothiophen-2-yl]-diphenylphosphane;[2-(2-diphenylphosphanyl-4-methoxy-5,6-dimethyl-3-phenylphenyl)-5-methoxy-3,4-dimethyl-6-phenylphenyl]-diphenylphosphane;[3-(4-diphenylphosphanyl-6-methoxy-2-methyl-3-pyridinyl)-6-methoxy-2-methyl-4-pyridinyl]-diphenylphosphane;[1-(2-diphenylphosphanyl-6-methylphenyl)naphthalen-2-yl]-diphenylphosphane;2,3,5-trimethyl-4-(2,4,5-trimethylthiophen-3-yl)thiophene has a molecular weight of 2875.41 g/mol, XLogP of 40.71, 35 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.

Where does this data come from?

All data for [3-(2-diphenylphosphanyl-1-benzothiophen-3-yl)-1-benzothiophen-2-yl]-diphenylphosphane;[2-(2-diphenylphosphanyl-4-methoxy-5,6-dimethyl-3-phenylphenyl)-5-methoxy-3,4-dimethyl-6-phenylphenyl]-diphenylphosphane;[3-(4-diphenylphosphanyl-6-methoxy-2-methyl-3-pyridinyl)-6-methoxy-2-methyl-4-pyridinyl]-diphenylphosphane;[1-(2-diphenylphosphanyl-6-methylphenyl)naphthalen-2-yl]-diphenylphosphane;2,3,5-trimethyl-4-(2,4,5-trimethylthiophen-3-yl)thiophene is sourced from PubChem (CID 158566636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).