diphenylphosphoryl-(2-ethenylphenyl)methanone

C21H17O2P — CID 22592682

IUPACdiphenylphosphoryl-(2-ethenylphenyl)methanone
SMILESC=Cc1ccccc1C(=O)P(=O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C21H17O2P/c1-2-17-11-9-10-16-20(17)21(22)24(23,18-12-5-3-6-13-18)19-14-7-4-8-15-19/h2-16H,1H2
InChIKeyPXPGYKMPPZKRLM-UHFFFAOYSA-N
MW332.34 g/mol
LogP4.48
Rot. Bonds5

About diphenylphosphoryl-(2-ethenylphenyl)methanone

diphenylphosphoryl-(2-ethenylphenyl)methanone (PubChem CID 22592682) has the molecular formula C21H17O2P and a molecular weight of 332.34 g/mol. Its IUPAC name is diphenylphosphoryl-(2-ethenylphenyl)methanone.

Molecular Properties

Compound Namediphenylphosphoryl-(2-ethenylphenyl)methanone
PubChem CID22592682
Molecular FormulaC21H17O2P
Molecular Weight332.34 g/mol
Exact Mass332.10
IUPAC Namediphenylphosphoryl-(2-ethenylphenyl)methanone
SMILESC=Cc1ccccc1C(=O)P(=O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C21H17O2P/c1-2-17-11-9-10-16-20(17)21(22)24(23,18-12-5-3-6-13-18)19-14-7-4-8-15-19/h2-16H,1H2
InChIKeyPXPGYKMPPZKRLM-UHFFFAOYSA-N
XLogP4.48
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.34
LogP ≤ 54.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze diphenylphosphoryl-(2-ethenylphenyl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-ethenylbenzoic acid;europium
CID 174925184
calcium;2-ethenylbenzoic acid;hydride
CID 174462542
(Z)-2,3-bis(2-ethenylphenyl)but-2-enedioic acid
CID 21425657
1-(2-ethenylphenyl)-2-phenylethane-1,2-dione;hydrochloride
CID 172775927
benzoic acid;2-ethenylbenzoic acid
CID 158841861
2-ethenyl-N-phenylbenzamide
CID 12541487
tris(2-ethenylbenzoate);iron(3+)
CID 18680456
CID 173313975
CID 173313975
sodium 2-ethenylbenzoate
CID 23721872
1-(2-ethenylphenyl)ethanone;prop-2-enoic acid
CID 175101646
[2-(2-ethenylphenyl)phenyl]-phenylmethanone
CID 71373352
2-ethenylbenzoic acid;prop-1-en-2-ylbenzene
CID 174866821

Frequently Asked Questions

What is the IUPAC name of diphenylphosphoryl-(2-ethenylphenyl)methanone?
The IUPAC name of diphenylphosphoryl-(2-ethenylphenyl)methanone (CID 22592682) is diphenylphosphoryl-(2-ethenylphenyl)methanone.
What is the SMILES notation for diphenylphosphoryl-(2-ethenylphenyl)methanone?
The canonical SMILES for diphenylphosphoryl-(2-ethenylphenyl)methanone is C=Cc1ccccc1C(=O)P(=O)(c1ccccc1)c1ccccc1.
What is the InChIKey of diphenylphosphoryl-(2-ethenylphenyl)methanone?
The InChIKey is PXPGYKMPPZKRLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17O2P/c1-2-17-11-9-10-16-20(17)21(22)24(23,18-12-5-3-6-13-18)19-14-7-4-8-15-19/h2-16H,1H2.
What are the key properties of diphenylphosphoryl-(2-ethenylphenyl)methanone?
diphenylphosphoryl-(2-ethenylphenyl)methanone has a molecular weight of 332.34 g/mol, XLogP of 4.48, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for diphenylphosphoryl-(2-ethenylphenyl)methanone is sourced from PubChem (CID 22592682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).