chempirical

Sodium phenylphosphinate

C6H6NaO2PCAS 4297-95-4164.08 g/mol

Open in Covalent MOL file
O−PHONa+

Properties

Molecular formula
C6H6NaO2P
Molar mass
164.08 g/mol
Exact mass
164.0003 Da
logP
0.40Crippen estimate
Polar surface area
37.3 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
1

Identifiers

CAS number
4297-95-4
SMILES
[O-]P(=O)c1ccccc1.[Na+]
InChIKey
NXOIWSPUTXWQSM-UHFFFAOYSA-N
InChI
InChI=1S/C6H7O2P.Na/c7-9(8)6-4-2-1-3-5-6;/h1-5,9H,(H,7,8);

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

5 names
  • Phosphinic acid, P-phenyl-, sodium salt (1:1)
  • Phosphinic acid, phenyl-, monosodium salt
  • Phenylphosphinic acid, sodium salt
  • Sodium benzenephosphinate
  • Monosodium phenylphosphonite

Work with Sodium phenylphosphinate

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Phenylphosphinic acid1779-48-239 % similar Sodium phenoxide139-02-638 % similar Sodium benzenesulfonate515-42-437 % similar Sodium benzoate532-32-135 % similar Sodium benzenesulfinate873-55-235 % similar Sodium phenylacetate114-70-533 % similar Sodium tetraphenylborate143-66-833 % similar Disodium phenyl phosphate3279-54-732 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook