chempirical

2-Carboxyethyl(phenyl)phosphinic acid

C9H11O4PCAS 14657-64-8214.16 g/mol

Open in Covalent MOL file
OHOPOOH
Carboxylic acid

Properties

Molecular formula
C9H11O4P
Molar mass
214.16 g/mol
Exact mass
214.0395 Da
Melting point
156–157 °C
logP
1.06Crippen estimate
Polar surface area
74.6 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
4

Identifiers

CAS number
14657-64-8
SMILES
O=C(O)CCP(=O)(O)c1ccccc1
InChIKey
MORLYCDUFHDZKO-UHFFFAOYSA-N
InChI
InChI=1S/C9H11O4P/c10-9(11)6-7-14(12,13)8-4-2-1-3-5-8/h1-5H,6-7H2,(H,10,11)(H,12,13)

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

Names and synonyms

11 names
  • Propanoic acid, 3-(hydroxyphenylphosphinyl)-
  • Propionic acid, 3-(hydroxyphenylphosphinyl)-
  • 3-(Hydroxyphenylphosphinyl)propanoic acid
  • 3-(Phenylphosphinyl)propionic acid
  • 3-(Hydroxyphenylphosphinyl)propionic acid
  • H 205 (Flame retardant)
  • H 205
  • Hiretar 205
  • 2-Carboxylethyl(phenyl)phosphinic acid
  • Phosgard PF 100
  • PZ 1201

Work with 2-Carboxyethyl(phenyl)phosphinic acid

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

P-(Hydroxymethyl)-P-phenylphosphinic acid61451-78-351 % similar Benzenepentanoic acid2270-20-446 % similar 3-Phosphonopropionic acid5962-42-546 % similar 8-Phenyloctanoic acid26547-51-345 % similar Benzenepentadecanoic acid40228-93-145 % similar 3-Phenoxypropionic acid7170-38-944 % similar δ-Oxobenzenepentanoic acid1501-05-943 % similar 5-Benzoylvaleric acid4144-62-143 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook