ethenyl(phenyl)phosphinic acid

C8H9O2P — CID 796940

IUPACethenyl(phenyl)phosphinic acid
SMILESC=CP(=O)(O)c1ccccc1
InChIInChI=1S/C8H9O2P/c1-2-11(9,10)8-6-4-3-5-7-8/h2-7H,1H2,(H,9,10)
InChIKeyWMGBGNNIJDWYJX-UHFFFAOYSA-N
MW168.13 g/mol
LogP1.73
Rot. Bonds2

About ethenyl(phenyl)phosphinic acid

ethenyl(phenyl)phosphinic acid (PubChem CID 796940) has the molecular formula C8H9O2P and a molecular weight of 168.13 g/mol. Its IUPAC name is ethenyl(phenyl)phosphinic acid.

Molecular Properties

Compound Nameethenyl(phenyl)phosphinic acid
PubChem CID796940
Molecular FormulaC8H9O2P
Molecular Weight168.13 g/mol
Exact Mass168.03
IUPAC Nameethenyl(phenyl)phosphinic acid
SMILESC=CP(=O)(O)c1ccccc1
InChIInChI=1S/C8H9O2P/c1-2-11(9,10)8-6-4-3-5-7-8/h2-7H,1H2,(H,9,10)
InChIKeyWMGBGNNIJDWYJX-UHFFFAOYSA-N
XLogP1.73
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.13
LogP ≤ 51.73
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 ethenyl(phenyl)phosphinic acid?
The IUPAC name of ethenyl(phenyl)phosphinic acid (CID 796940) is ethenyl(phenyl)phosphinic acid.
What is the SMILES notation for ethenyl(phenyl)phosphinic acid?
The canonical SMILES for ethenyl(phenyl)phosphinic acid is C=CP(=O)(O)c1ccccc1.
What is the InChIKey of ethenyl(phenyl)phosphinic acid?
The InChIKey is WMGBGNNIJDWYJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9O2P/c1-2-11(9,10)8-6-4-3-5-7-8/h2-7H,1H2,(H,9,10).
What are the key properties of ethenyl(phenyl)phosphinic acid?
ethenyl(phenyl)phosphinic acid has a molecular weight of 168.13 g/mol, XLogP of 1.73, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethenyl(phenyl)phosphinic acid is sourced from PubChem (CID 796940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).