4-(2-phenylethylphosphanyl)phenol

C14H15OP — CID 150809826

IUPAC4-(2-phenylethylphosphanyl)phenol
SMILESOc1ccc(PCCc2ccccc2)cc1
InChIInChI=1S/C14H15OP/c15-13-6-8-14(9-7-13)16-11-10-12-4-2-1-3-5-12/h1-9,15-16H,10-11H2
InChIKeyKHQSAOPRLXGVRV-UHFFFAOYSA-N
MW230.25 g/mol
LogP2.94
Rot. Bonds4

About 4-(2-phenylethylphosphanyl)phenol

4-(2-phenylethylphosphanyl)phenol (PubChem CID 150809826) has the molecular formula C14H15OP and a molecular weight of 230.25 g/mol. Its IUPAC name is 4-(2-phenylethylphosphanyl)phenol.

Molecular Properties

Compound Name4-(2-phenylethylphosphanyl)phenol
PubChem CID150809826
Molecular FormulaC14H15OP
Molecular Weight230.25 g/mol
Exact Mass230.09
IUPAC Name4-(2-phenylethylphosphanyl)phenol
SMILESOc1ccc(PCCc2ccccc2)cc1
InChIInChI=1S/C14H15OP/c15-13-6-8-14(9-7-13)16-11-10-12-4-2-1-3-5-12/h1-9,15-16H,10-11H2
InChIKeyKHQSAOPRLXGVRV-UHFFFAOYSA-N
XLogP2.94
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.25
LogP ≤ 52.94
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 4-(2-phenylethylphosphanyl)phenol?
The IUPAC name of 4-(2-phenylethylphosphanyl)phenol (CID 150809826) is 4-(2-phenylethylphosphanyl)phenol.
What is the SMILES notation for 4-(2-phenylethylphosphanyl)phenol?
The canonical SMILES for 4-(2-phenylethylphosphanyl)phenol is Oc1ccc(PCCc2ccccc2)cc1.
What is the InChIKey of 4-(2-phenylethylphosphanyl)phenol?
The InChIKey is KHQSAOPRLXGVRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15OP/c15-13-6-8-14(9-7-13)16-11-10-12-4-2-1-3-5-12/h1-9,15-16H,10-11H2.
What are the key properties of 4-(2-phenylethylphosphanyl)phenol?
4-(2-phenylethylphosphanyl)phenol has a molecular weight of 230.25 g/mol, XLogP of 2.94, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-phenylethylphosphanyl)phenol is sourced from PubChem (CID 150809826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).