hydroxy-diphenyl-bis(2-phenylphenyl)-λ5-phosphane

C36H29OP — CID 141029381

IUPAChydroxy-diphenyl-bis(2-phenylphenyl)-λ5-phosphane
SMILESOP(c1ccccc1)(c1ccccc1)(c1ccccc1-c1ccccc1)c1ccccc1-c1ccccc1
InChIInChI=1S/C36H29OP/c37-38(31-21-9-3-10-22-31,32-23-11-4-12-24-32,35-27-15-13-25-33(35)29-17-5-1-6-18-29)36-28-16-14-26-34(36)30-19-7-2-8-20-30/h1-28,37H
InChIKeySOSHQPDPCVBVMH-UHFFFAOYSA-N
MW508.60 g/mol
LogP7.08
Rot. Bonds6

About hydroxy-diphenyl-bis(2-phenylphenyl)-λ5-phosphane

hydroxy-diphenyl-bis(2-phenylphenyl)-λ5-phosphane (PubChem CID 141029381) has the molecular formula C36H29OP and a molecular weight of 508.60 g/mol. Its IUPAC name is hydroxy-diphenyl-bis(2-phenylphenyl)-λ5-phosphane.

Molecular Properties

Compound Namehydroxy-diphenyl-bis(2-phenylphenyl)-λ5-phosphane
PubChem CID141029381
Molecular FormulaC36H29OP
Molecular Weight508.60 g/mol
Exact Mass508.20
IUPAC Namehydroxy-diphenyl-bis(2-phenylphenyl)-λ5-phosphane
SMILESOP(c1ccccc1)(c1ccccc1)(c1ccccc1-c1ccccc1)c1ccccc1-c1ccccc1
InChIInChI=1S/C36H29OP/c37-38(31-21-9-3-10-22-31,32-23-11-4-12-24-32,35-27-15-13-25-33(35)29-17-5-1-6-18-29)36-28-16-14-26-34(36)30-19-7-2-8-20-30/h1-28,37H
InChIKeySOSHQPDPCVBVMH-UHFFFAOYSA-N
XLogP7.08
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms38
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500508.60
LogP ≤ 57.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of hydroxy-diphenyl-bis(2-phenylphenyl)-λ5-phosphane?
The IUPAC name of hydroxy-diphenyl-bis(2-phenylphenyl)-λ5-phosphane (CID 141029381) is hydroxy-diphenyl-bis(2-phenylphenyl)-λ5-phosphane.
What is the SMILES notation for hydroxy-diphenyl-bis(2-phenylphenyl)-λ5-phosphane?
The canonical SMILES for hydroxy-diphenyl-bis(2-phenylphenyl)-λ5-phosphane is OP(c1ccccc1)(c1ccccc1)(c1ccccc1-c1ccccc1)c1ccccc1-c1ccccc1.
What is the InChIKey of hydroxy-diphenyl-bis(2-phenylphenyl)-λ5-phosphane?
The InChIKey is SOSHQPDPCVBVMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H29OP/c37-38(31-21-9-3-10-22-31,32-23-11-4-12-24-32,35-27-15-13-25-33(35)29-17-5-1-6-18-29)36-28-16-14-26-34(36)30-19-7-2-8-20-30/h1-28,37H.
What are the key properties of hydroxy-diphenyl-bis(2-phenylphenyl)-λ5-phosphane?
hydroxy-diphenyl-bis(2-phenylphenyl)-λ5-phosphane has a molecular weight of 508.60 g/mol, XLogP of 7.08, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for hydroxy-diphenyl-bis(2-phenylphenyl)-λ5-phosphane is sourced from PubChem (CID 141029381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).