chempirical

Bromophos-ethyl

C10H12BrCl2O3PSCAS 4824-78-6394.04 g/mol

Open in Covalent MOL file
OPSOOClBrCl
Aryl halide

Properties

Molecular formula
C10H12BrCl2O3PS
Molar mass
394.04 g/mol
Exact mass
391.8805 Da
Density
1.52–1.55 g/mL (at 20 °C)
Boiling point
122–133 °C
logP
5.43Crippen estimate
Polar surface area
27.7 Ų
H-bond donors / acceptors
0 / 4
Rotatable bonds
6

Identifiers

CAS number
4824-78-6
SMILES
CCOP(=S)(OCC)Oc1cc(Cl)c(Br)cc1Cl
InChIKey
KWGUFOITWDSNQY-UHFFFAOYSA-N
InChI
InChI=1S/C10H12BrCl2O3PS/c1-3-14-17(18,15-4-2)16-10-6-8(12)7(11)5-9(10)13/h5-6H,3-4H2,1-2H3

Weigh it out

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

Names and synonyms

10 names
  • Phosphorothioic acid, O-(4-bromo-2,5-dichlorophenyl) O,O-diethyl ester
  • O-(4-Bromo-2,5-dichlorophenyl) O,O-diethyl phosphorothioate
  • Ethyl bromophos
  • OMS 659
  • O,O-Diethyl O-(2,5-dichloro-4-bromophenyl) thiophosphate
  • Nexagan G
  • Filariol 60
  • Filariol
  • Nexagan
  • Bromophos A

Work with Bromophos-ethyl

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Bromophos2104-96-368 % similar Dichlofenthion97-17-663 % similar Chlorpyrifos2921-88-255 % similar Trichloronate327-98-051 % similar Leptophos21609-90-549 % similar Fenchlorphos299-84-348 % similar Sulfotep3689-24-543 % similar Quinalphos13593-03-840 % similar

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

Elsewhere

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