chempirical

Bromophos

C8H8BrCl2O3PSCAS 2104-96-3365.99 g/mol

Open in Covalent MOL file
OPSOOClBrCl
Aryl halide

Properties

Molecular formula
C8H8BrCl2O3PS
Molar mass
365.99 g/mol
Exact mass
363.8492 Da
Melting point
53–54 °C
Boiling point
140–142 °C (at 0.01 Torr)
logP
4.65Crippen estimate
Polar surface area
27.7 Ų
H-bond donors / acceptors
0 / 4
Rotatable bonds
4

Identifiers

CAS number
2104-96-3
SMILES
COP(=S)(OC)Oc1cc(Cl)c(Br)cc1Cl
InChIKey
NYQDCVLCJXRDSK-UHFFFAOYSA-N
InChI
InChI=1S/C8H8BrCl2O3PS/c1-12-15(16,13-2)14-8-4-6(10)5(9)3-7(8)11/h3-4H,1-2H3

Weigh it out

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

Names and synonyms

25 names · show all
  • Phosphorothioic acid, O-(4-bromo-2,5-dichlorophenyl) O,O-dimethyl ester
  • Cela S 1942
  • S 1942
  • O-(4-Bromo-2,5-dichlorophenyl) O,O-dimethyl phosphorothioate
  • 4-Bromo-2,5-dichlorophenyl dimethyl phosphorothionate
  • O,O-Dimethyl O-(4-bromo-2,5-dichlorophenyl) phosphorothioate
  • O,O-Dimethyl-O-(2,5-dichloro-4-bromophenyl)phosphorothioate
  • O,O-Dimethyl O-(2,5-dichloro-4-bromophenyl) thiophosphate
  • EL 400
  • Nexion
  • Nexion 40
  • Bromofos
  • OMS 658
  • Nexion LC 40
  • Drillzid
  • Bromovur
  • Bromophos-methyl
  • Nexion 5G
  • Metabrom
  • Sovinexion
  • Omexan
  • Nexion 40EC
  • Nexion 25WP
  • O,O-Dimethyl O-(4-bromo-2,5-dichlorophenyl) phosphorothionate
  • NSC 527602

Work with Bromophos

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

Fenchlorphos299-84-373 % similar Bromophos-ethyl4824-78-668 % similar Leptophos21609-90-562 % similar Tolclofos-methyl57018-04-951 % similar Chlorpyrifos-methyl5598-13-050 % similar Dicapthon2463-84-549 % similar Dichlofenthion97-17-641 % similar 4-Bromo-2,5-dichlorophenol1940-42-738 % similar

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

Elsewhere

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