chempirical

Dichlofenthion

C10H13Cl2O3PSCAS 97-17-6315.14 g/mol

Open in Covalent MOL file
OPSOOClCl
Aryl halide

Properties

Molecular formula
C10H13Cl2O3PS
Molar mass
315.14 g/mol
Exact mass
313.9700 Da
Density
1.3 g/mL (at 20 °C)
Boiling point
164–169 °C (at 0.1 Torr)
logP
4.67Crippen estimate
Polar surface area
27.7 Ų
H-bond donors / acceptors
0 / 4
Rotatable bonds
6

Identifiers

CAS number
97-17-6
SMILES
CCOP(=S)(OCC)Oc1ccc(Cl)cc1Cl
InChIKey
WGOWCPGHOCIHBW-UHFFFAOYSA-N
InChI
InChI=1S/C10H13Cl2O3PS/c1-3-13-16(17,14-4-2)15-10-6-5-8(11)7-9(10)12/h5-7H,3-4H2,1-2H3

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Names and synonyms

13 names · show all
  • Phosphorothioic acid, O-(2,4-dichlorophenyl) O,O-diethyl ester
  • VC 13
  • ENT 17470
  • O,O-Diethyl O-(2,4-dichlorophenyl) phosphorothioate
  • ECP
  • Nemacide
  • VC 13 Nemacide
  • O-(2,4-Dichlorophenyl) O,O-diethyl phosphorothioate
  • VC 1-13
  • Hexanema
  • ECP (pesticide)
  • VC 13 (pesticide)
  • NSC 52964

Work with Dichlofenthion

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

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

Elsewhere

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