chempirical

Dimethyl phosphate

C2H7O4PCAS 813-78-5126.05 g/mol

Open in Covalent MOL file
OPOOHO
Phosphate

Properties

Molecular formula
C2H7O4P
Molar mass
126.05 g/mol
Exact mass
126.0082 Da
Density
1.3337 g/mL (at 20 °C)
Boiling point
113 °C (at 0.023 Torr)
logP
0.38Crippen estimate
Polar surface area
55.8 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
2

Identifiers

CAS number
813-78-5
SMILES
COP(=O)(O)OC
InChIKey
KKUKTXOBAWVSHC-UHFFFAOYSA-N
InChI
InChI=1S/C2H7O4P/c1-5-7(3,4)6-2/h1-2H3,(H,3,4)

Weigh it out

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

Names and synonyms

7 names
  • Phosphoric acid, dimethyl ester
  • Methyl phosphate ((CH3O)2(HO)PO)
  • Dimethyl hydrogen phosphate
  • O,O-Dimethyl phosphate
  • O,O-Dimethyl hydrogen phosphate
  • DMP
  • NSC 2676

Work with Dimethyl phosphate

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