chempirical

Epn (insecticide)

C14H14NO4PSCAS 2104-64-5323.30 g/mol

Open in Covalent MOL file
OPSON+OO−
Nitro

Properties

Molecular formula
C14H14NO4PS
Molar mass
323.30 g/mol
Exact mass
323.0381 Da
Density
1.27 g/mL (at 25 °C)
Melting point
36 °C
Boiling point
215 °C (at 5 Torr)
logP
3.65Crippen estimate
Polar surface area
61.6 Ų
H-bond donors / acceptors
0 / 5
Rotatable bonds
6

Identifiers

CAS number
2104-64-5
SMILES
CCOP(=S)(Oc1ccc([N+](=O)[O-])cc1)c1ccccc1
InChIKey
AIGRXSNSLVJMEA-UHFFFAOYSA-N
InChI
InChI=1S/C14H14NO4PS/c1-2-18-20(21,14-6-4-3-5-7-14)19-13-10-8-12(9-11-13)15(16)17/h3-11H,2H2,1H3

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

Names and synonyms

13 names · show all
  • Phosphonothioic acid, P-phenyl-, O-ethyl O-(4-nitrophenyl) ester
  • Phosphonothioic acid, phenyl-, O-ethyl O-(p-nitrophenyl) ester
  • Phosphonothioic acid, phenyl-, O-ethyl O-(4-nitrophenyl) ester
  • Phosphonothioic acid, phenyl-, ethyl p-nitrophenyl ester
  • EPN 300
  • EPN
  • O-Ethyl O-(4-nitrophenyl) benzenethionophosphonate
  • O-Ethyl O-p-nitrophenyl benzenethiophosphonate
  • O-Ethyl O-(4-nitrophenyl) phenylphosphonothioate
  • O-Ethyl O-(p-nitrophenyl) phenylphosphonothioate
  • Santox
  • NSC 404840
  • NSC 8943

Work with Epn (insecticide)

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

Parathion56-38-267 % similar Cyanofenphos13067-93-158 % similar P-Nitrophenetole100-29-852 % similar Parathion methyl298-00-050 % similar Bis(P-nitrophenyl) phosphate645-15-844 % similar 4-Nitroanisole100-17-442 % similar Sodium bis(4-nitrophenyl) phosphate4043-96-342 % similar Disodium P-nitrophenyl phosphate4264-83-942 % similar

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

Elsewhere

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