chempirical

o-Chlorophenyl dichlorophosphate

C6H4Cl3O2PCAS 15074-54-1245.42 g/mol

Open in Covalent MOL file
OPClClOCl
Aryl halide

Properties

Molecular formula
C6H4Cl3O2P
Molar mass
245.42 g/mol
Exact mass
243.9014 Da
Boiling point
85 °C (at 0.6 Torr)
logP
4.30Crippen estimate
Polar surface area
26.3 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
2

Identifiers

CAS number
15074-54-1
SMILES
O=P(Cl)(Cl)Oc1ccccc1Cl
InChIKey
VLDPXPPHXDGHEW-UHFFFAOYSA-N
InChI
InChI=1S/C6H4Cl3O2P/c7-5-3-1-2-4-6(5)11-12(8,9)10/h1-4H

Weigh it out

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

Names and synonyms

10 names
  • Phosphorodichloridic acid, 2-chlorophenyl ester
  • Phosphorodichloridic acid, o-chlorophenyl ester
  • Phenol, o-chloro-, phosphorodichloridate
  • o-Chlorophenyl phosphorodichloridate
  • 2-Chlorophenyl phosphorodichloridate
  • 2-Chlorophenyl dichlorophosphate
  • 2-Chlorophenyl phosphodichloridate
  • 2-Chlorophenyl dichlorophosphinate
  • (2-Chlorophenoxy)phosphonoyl dichloride
  • 1-Chloro-2-dichlorophosphoryloxybenzene

Work with o-Chlorophenyl dichlorophosphate

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

Phenyl phosphorodichloridate770-12-759 % similar 2-Chloroanisole766-51-850 % similar 2-Chlorophenyl acetate4525-75-142 % similar 1-Chloro-2-ethoxybenzene614-72-241 % similar 2-(2-Chlorophenoxy)ethanol15480-00-939 % similar Diphosphoryl chloride13498-14-138 % similar O-Chlorophenoxyacetic acid614-61-938 % similar 1,2-Dichlorobenzene95-50-138 % similar

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

Same formula

4-Chlorophenyl phosphorodichloridate772-79-2

Elsewhere

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