2-(2-dicyclohexylphosphanylphenyl)phenol

C24H31OP — CID 7015412

IUPAC2-(2-dicyclohexylphosphanylphenyl)phenol
SMILESOc1ccccc1-c1ccccc1P(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C24H31OP/c25-23-17-9-7-15-21(23)22-16-8-10-18-24(22)26(19-11-3-1-4-12-19)20-13-5-2-6-14-20/h7-10,15-20,25H,1-6,11-14H2
InChIKeyBEHKYOVJBSHZRC-UHFFFAOYSA-N
MW366.49 g/mol
LogP6.83
Rot. Bonds4

About 2-(2-dicyclohexylphosphanylphenyl)phenol

2-(2-dicyclohexylphosphanylphenyl)phenol (PubChem CID 7015412) has the molecular formula C24H31OP and a molecular weight of 366.49 g/mol. Its IUPAC name is 2-(2-dicyclohexylphosphanylphenyl)phenol.

Molecular Properties

Compound Name2-(2-dicyclohexylphosphanylphenyl)phenol
PubChem CID7015412
Molecular FormulaC24H31OP
Molecular Weight366.49 g/mol
Exact Mass366.21
IUPAC Name2-(2-dicyclohexylphosphanylphenyl)phenol
SMILESOc1ccccc1-c1ccccc1P(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C24H31OP/c25-23-17-9-7-15-21(23)22-16-8-10-18-24(22)26(19-11-3-1-4-12-19)20-13-5-2-6-14-20/h7-10,15-20,25H,1-6,11-14H2
InChIKeyBEHKYOVJBSHZRC-UHFFFAOYSA-N
XLogP6.83
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.49
LogP ≤ 56.83
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-dicyclohexylphosphanylphenyl)phenol?
The IUPAC name of 2-(2-dicyclohexylphosphanylphenyl)phenol (CID 7015412) is 2-(2-dicyclohexylphosphanylphenyl)phenol.
What is the SMILES notation for 2-(2-dicyclohexylphosphanylphenyl)phenol?
The canonical SMILES for 2-(2-dicyclohexylphosphanylphenyl)phenol is Oc1ccccc1-c1ccccc1P(C1CCCCC1)C1CCCCC1.
What is the InChIKey of 2-(2-dicyclohexylphosphanylphenyl)phenol?
The InChIKey is BEHKYOVJBSHZRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H31OP/c25-23-17-9-7-15-21(23)22-16-8-10-18-24(22)26(19-11-3-1-4-12-19)20-13-5-2-6-14-20/h7-10,15-20,25H,1-6,11-14H2.
What are the key properties of 2-(2-dicyclohexylphosphanylphenyl)phenol?
2-(2-dicyclohexylphosphanylphenyl)phenol has a molecular weight of 366.49 g/mol, XLogP of 6.83, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-dicyclohexylphosphanylphenyl)phenol is sourced from PubChem (CID 7015412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).