Dimethyl P-phenylphosphonate

C₈H₁₁O₃PCAS 2240-41-7186.15 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₈H₁₁O₃P
Molar mass: 186.15 g/mol
Exact mass: 186.0446 Da
Boiling point: 103–104 °C (at 4 Torr)
logP: 1.80Crippen estimate
Polar surface area: 35.5 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 3

Identifiers

CAS number

2240-41-7

SMILES

COP(=O)(OC)c1ccccc1

InChIKey

OXDOANYFRLHSML-UHFFFAOYSA-N

InChI

InChI=1S/C8H11O3P/c1-10-12(9,11-2)8-6-4-3-5-7-8/h3-7H,1-2H3

Weigh it out

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

Names and synonyms

8 names

Phosphonic acid, P-phenyl-, dimethyl ester
Phosphonic acid, phenyl-, dimethyl ester
Dimethyl phenylphosphonate
Dimethyl benzenephosphonate
Phenylphosphonic acid dimethyl ester
Dimethoxyphenylphosphine oxide
NSC 62258
O,O-Dimethyl phenylphosphonate

Work with Dimethyl P-phenylphosphonate

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook