2-diphenylphosphorylphenol

C18H15O2P — CID 626229

IUPAC2-diphenylphosphorylphenol
SMILESO=P(c1ccccc1)(c1ccccc1)c1ccccc1O
InChIInChI=1S/C18H15O2P/c19-17-13-7-8-14-18(17)21(20,15-9-3-1-4-10-15)16-11-5-2-6-12-16/h1-14,19H
InChIKeyXZQDLMWMHRNMDY-UHFFFAOYSA-N
MW294.29 g/mol
LogP3.03
Rot. Bonds3

About 2-diphenylphosphorylphenol

2-diphenylphosphorylphenol (PubChem CID 626229) has the molecular formula C18H15O2P and a molecular weight of 294.29 g/mol. Its IUPAC name is 2-diphenylphosphorylphenol.

Molecular Properties

Compound Name2-diphenylphosphorylphenol
PubChem CID626229
Molecular FormulaC18H15O2P
Molecular Weight294.29 g/mol
Exact Mass294.08
IUPAC Name2-diphenylphosphorylphenol
SMILESO=P(c1ccccc1)(c1ccccc1)c1ccccc1O
InChIInChI=1S/C18H15O2P/c19-17-13-7-8-14-18(17)21(20,15-9-3-1-4-10-15)16-11-5-2-6-12-16/h1-14,19H
InChIKeyXZQDLMWMHRNMDY-UHFFFAOYSA-N
XLogP3.03
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.29
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-[tert-butyl(phenyl)phosphoryl]phenol
CID 127258156
diphenylphosphorylbenzene;terbium
CID 86595283
2-(2-diphenylphosphorylphenyl)propan-2-ol
CID 12734316
1-diphenylphosphorylnaphthalene
CID 11023927
2-diphenylphosphoryl-4-ethoxyphenol
CID 175172979
2-diphenylphosphoryl-6-nitrophenol
CID 3678150
N-(2-diphenylphosphorylphenyl)acetamide
CID 71531508
1-(chloromethyl)-2-diphenylphosphorylbenzene
CID 152708651
1-diphenylphosphoryl-2-(2-diphenylphosphorylphenoxy)benzene;ethane
CID 144799075
1,5-bis(diphenylphosphoryl)anthracene
CID 88535905
1-diphenylphosphoryl-2-(trifluoromethyl)benzene
CID 5232149
1-diphenylphosphorylnaphthalene;terbium
CID 161386720

Frequently Asked Questions

What is the IUPAC name of 2-diphenylphosphorylphenol?
The IUPAC name of 2-diphenylphosphorylphenol (CID 626229) is 2-diphenylphosphorylphenol.
What is the SMILES notation for 2-diphenylphosphorylphenol?
The canonical SMILES for 2-diphenylphosphorylphenol is O=P(c1ccccc1)(c1ccccc1)c1ccccc1O.
What is the InChIKey of 2-diphenylphosphorylphenol?
The InChIKey is XZQDLMWMHRNMDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15O2P/c19-17-13-7-8-14-18(17)21(20,15-9-3-1-4-10-15)16-11-5-2-6-12-16/h1-14,19H.
What are the key properties of 2-diphenylphosphorylphenol?
2-diphenylphosphorylphenol has a molecular weight of 294.29 g/mol, XLogP of 3.03, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-diphenylphosphorylphenol is sourced from PubChem (CID 626229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).