chempirical

Dimethyl chlorothiophosphate

C2H6ClO2PSCAS 2524-03-0160.55 g/mol

Open in Covalent MOL file
OPSClO

Properties

Molecular formula
C2H6ClO2PS
Molar mass
160.55 g/mol
Exact mass
159.9515 Da
Boiling point
66–67 °C (at 16 Torr)
logP
1.74Crippen estimate
Polar surface area
18.5 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
2

Identifiers

CAS number
2524-03-0
SMILES
COP(=S)(Cl)OC
InChIKey
XFBJRFNXPUCPKU-UHFFFAOYSA-N
InChI
InChI=1S/C2H6ClO2PS/c1-4-6(3,7)5-2/h1-2H3

Weigh it out

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

Names and synonyms

19 names · show all
  • Phosphorochloridothioic acid, O,O-dimethyl ester
  • Methyl phosphorochloridothioate ((MeO)2ClPS)
  • Chlorodimethoxyphosphine sulfide
  • Dimethyl chlorothionophosphate
  • Dimethyl thiophosphorochloridate
  • O,O-Dimethyl phosphorochloridothioate
  • O,O-Dimethyl chlorothiophosphate
  • O,O-Dimethyl phosphorothionochloridate
  • O,O-Dimethyl thiophosphoric acid chloride
  • Dimethoxy thiophosphonyl chloride
  • O,O-Dimethylthionophosphoryl chloride
  • Dimethyl thionophosphorochloridate
  • O,O-Dimethyl thiophosphoryl chloride
  • O,O-Dimethyl chlorothionophosphate
  • O,O-Dimethyl thionophosphorochloridate
  • O,O-Dimethyl phosphorochlorothioate
  • Dimethyl chlorophosphorothioate
  • O,O-Dimethyl chlorophosphorothioate
  • NSC 132984

Work with Dimethyl chlorothiophosphate

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

O,O-Diethyl phosphorochloridothioate2524-04-143 % similar O,O-Dimethyl phosphoramidothioate17321-47-036 % similar Methyl dichlorophosphate677-24-736 % similar Dimethyl dithiophosphoric acid756-80-936 % similar

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

Elsewhere

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