chempirical

Cyanofenphos

C15H14NO2PSCAS 13067-93-1303.32 g/mol

Open in Covalent MOL file
OPSON
Nitrile

Properties

Molecular formula
C15H14NO2PS
Molar mass
303.32 g/mol
Exact mass
303.0483 Da
Melting point
83 °C
logP
3.61Crippen estimate
Polar surface area
42.3 Ų
H-bond donors / acceptors
0 / 4
Rotatable bonds
5

Identifiers

CAS number
13067-93-1
SMILES
CCOP(=S)(Oc1ccc(C#N)cc1)c1ccccc1
InChIKey
LRNJHZNPJSPMGK-UHFFFAOYSA-N
InChI
InChI=1S/C15H14NO2PS/c1-2-17-19(20,15-6-4-3-5-7-15)18-14-10-8-13(12-16)9-11-14/h3-11H,2H2,1H3

Weigh it out

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

Names and synonyms

15 names · show all
  • Phosphonothioic acid, P-phenyl-, O-(4-cyanophenyl) O-ethyl ester
  • Phosphonothioic acid, phenyl-, O-ethyl ester, O-ester with p-hydroxybenzonitrile
  • Phosphonothioic acid, phenyl-, O-(4-cyanophenyl) O-ethyl ester
  • Phosphonothioic acid, phenyl-, O-p-cyanophenyl O-ethyl ester
  • S 4087
  • Monsanto CP-19699
  • Surecide
  • B 10094
  • CP 19699
  • Cyanophenphos
  • CYP
  • O-Ethyl O-(4-cyanophenyl) phenylphosphonothioate
  • OMS 870
  • Surazon
  • SUD

Work with Cyanofenphos

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

Epn (insecticide)2104-64-558 % similar Cyanophos2636-26-248 % similar 4′-Ethoxy[1,1′-biphenyl]-4-carbonitrile58743-78-547 % similar 3-Ethoxybenzonitrile25117-75-339 % similar 4-Butoxybenzonitrile5203-14-539 % similar 4-Methoxybenzonitrile874-90-839 % similar 4′-Propoxy[1,1′-biphenyl]-4-carbonitrile52709-86-138 % similar Ethyl p-cyanobenzoate7153-22-238 % similar

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

Elsewhere

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