chempirical

P-(Hydroxymethyl)-P-phenylphosphinic acid

C7H9O3PCAS 61451-78-3172.12 g/mol

Open in Covalent MOL file
OPOHHO
Alcohol

Properties

Molecular formula
C7H9O3P
Molar mass
172.12 g/mol
Exact mass
172.0289 Da
Melting point
138–139 °C
logP
0.53Crippen estimate
Polar surface area
57.5 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
2

Identifiers

CAS number
61451-78-3
SMILES
O=P(O)(CO)c1ccccc1
InChIKey
SYBJZXZBVFWDAO-UHFFFAOYSA-N
InChI
InChI=1S/C7H9O3P/c8-6-11(9,10)7-4-2-1-3-5-7/h1-5,8H,6H2,(H,9,10)

Weigh it out

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

Names and synonyms

5 names
  • Phosphinic acid, P-(hydroxymethyl)-P-phenyl-
  • Phosphinic acid, (hydroxymethyl)phenyl-
  • Hydroxymethyl(phenyl)phosphinic acid
  • (Hydroxymethyl)phenyl phosphinate
  • HMPPA

Work with P-(Hydroxymethyl)-P-phenylphosphinic 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

2-Carboxyethyl(phenyl)phosphinic acid14657-64-851 % similar Phenylphosphonic acid1571-33-146 % similar Diphenylphosphinic acid1707-03-546 % similar Triphenylphosphine oxide791-28-641 % similar Ethyldiphenylphosphine oxide1733-57-938 % similar Diphenylphosphinic chloride1499-21-437 % similar Methyldiphenylphosphine oxide2129-89-737 % similar Phenylphosphonic dichloride824-72-637 % similar

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

Same formula

Benzylphosphonic acid6881-57-8

Elsewhere

PubChem CAS Common Chemistry NIST WebBook