4-[methyl(phenyl)phosphoryl]phenol

C13H13O2P — CID 10105326

IUPAC4-[methyl(phenyl)phosphoryl]phenol
SMILESCP(=O)(c1ccccc1)c1ccc(O)cc1
InChIInChI=1S/C13H13O2P/c1-16(15,12-5-3-2-4-6-12)13-9-7-11(14)8-10-13/h2-10,14H,1H3
InChIKeyYOPXHFOSEDBETP-UHFFFAOYSA-N
MW232.22 g/mol
LogP2.34
Rot. Bonds2

About 4-[methyl(phenyl)phosphoryl]phenol

4-[methyl(phenyl)phosphoryl]phenol (PubChem CID 10105326) has the molecular formula C13H13O2P and a molecular weight of 232.22 g/mol. Its IUPAC name is 4-[methyl(phenyl)phosphoryl]phenol.

Molecular Properties

Compound Name4-[methyl(phenyl)phosphoryl]phenol
PubChem CID10105326
Molecular FormulaC13H13O2P
Molecular Weight232.22 g/mol
Exact Mass232.07
IUPAC Name4-[methyl(phenyl)phosphoryl]phenol
SMILESCP(=O)(c1ccccc1)c1ccc(O)cc1
InChIInChI=1S/C13H13O2P/c1-16(15,12-5-3-2-4-6-12)13-9-7-11(14)8-10-13/h2-10,14H,1H3
InChIKeyYOPXHFOSEDBETP-UHFFFAOYSA-N
XLogP2.34
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.22
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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-[methyl(phenyl)phosphoryl]phenol?
The IUPAC name of 4-[methyl(phenyl)phosphoryl]phenol (CID 10105326) is 4-[methyl(phenyl)phosphoryl]phenol.
What is the SMILES notation for 4-[methyl(phenyl)phosphoryl]phenol?
The canonical SMILES for 4-[methyl(phenyl)phosphoryl]phenol is CP(=O)(c1ccccc1)c1ccc(O)cc1.
What is the InChIKey of 4-[methyl(phenyl)phosphoryl]phenol?
The InChIKey is YOPXHFOSEDBETP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13O2P/c1-16(15,12-5-3-2-4-6-12)13-9-7-11(14)8-10-13/h2-10,14H,1H3.
What are the key properties of 4-[methyl(phenyl)phosphoryl]phenol?
4-[methyl(phenyl)phosphoryl]phenol has a molecular weight of 232.22 g/mol, XLogP of 2.34, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[methyl(phenyl)phosphoryl]phenol is sourced from PubChem (CID 10105326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).