2-(2-cyclohexylphenyl)-6-phenylphosphanylphenol

C24H25OP — CID 67641016

IUPAC2-(2-cyclohexylphenyl)-6-phenylphosphanylphenol
SMILESOc1c(Pc2ccccc2)cccc1-c1ccccc1C1CCCCC1
InChIInChI=1S/C24H25OP/c25-24-22(16-9-17-23(24)26-19-12-5-2-6-13-19)21-15-8-7-14-20(21)18-10-3-1-4-11-18/h2,5-9,12-18,25-26H,1,3-4,10-11H2
InChIKeyAWVBFLJMNMVBKO-UHFFFAOYSA-N
MW360.44 g/mol
LogP5.74
Rot. Bonds4

About 2-(2-cyclohexylphenyl)-6-phenylphosphanylphenol

2-(2-cyclohexylphenyl)-6-phenylphosphanylphenol (PubChem CID 67641016) has the molecular formula C24H25OP and a molecular weight of 360.44 g/mol. Its IUPAC name is 2-(2-cyclohexylphenyl)-6-phenylphosphanylphenol.

Molecular Properties

Compound Name2-(2-cyclohexylphenyl)-6-phenylphosphanylphenol
PubChem CID67641016
Molecular FormulaC24H25OP
Molecular Weight360.44 g/mol
Exact Mass360.16
IUPAC Name2-(2-cyclohexylphenyl)-6-phenylphosphanylphenol
SMILESOc1c(Pc2ccccc2)cccc1-c1ccccc1C1CCCCC1
InChIInChI=1S/C24H25OP/c25-24-22(16-9-17-23(24)26-19-12-5-2-6-13-19)21-15-8-7-14-20(21)18-10-3-1-4-11-18/h2,5-9,12-18,25-26H,1,3-4,10-11H2
InChIKeyAWVBFLJMNMVBKO-UHFFFAOYSA-N
XLogP5.74
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500360.44
LogP ≤ 55.74
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 2-(2-cyclohexylphenyl)-6-phenylphosphanylphenol?
The IUPAC name of 2-(2-cyclohexylphenyl)-6-phenylphosphanylphenol (CID 67641016) is 2-(2-cyclohexylphenyl)-6-phenylphosphanylphenol.
What is the SMILES notation for 2-(2-cyclohexylphenyl)-6-phenylphosphanylphenol?
The canonical SMILES for 2-(2-cyclohexylphenyl)-6-phenylphosphanylphenol is Oc1c(Pc2ccccc2)cccc1-c1ccccc1C1CCCCC1.
What is the InChIKey of 2-(2-cyclohexylphenyl)-6-phenylphosphanylphenol?
The InChIKey is AWVBFLJMNMVBKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25OP/c25-24-22(16-9-17-23(24)26-19-12-5-2-6-13-19)21-15-8-7-14-20(21)18-10-3-1-4-11-18/h2,5-9,12-18,25-26H,1,3-4,10-11H2.
What are the key properties of 2-(2-cyclohexylphenyl)-6-phenylphosphanylphenol?
2-(2-cyclohexylphenyl)-6-phenylphosphanylphenol has a molecular weight of 360.44 g/mol, XLogP of 5.74, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyclohexylphenyl)-6-phenylphosphanylphenol is sourced from PubChem (CID 67641016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).