chempirical

2,4′-Dichloroacetophenone

C8H6Cl2OCAS 937-20-2189.03 g/mol

Open in Covalent MOL file
OClCl
Alkyl halideAryl halideKetone

Properties

Molecular formula
C8H6Cl2O
Molar mass
189.03 g/mol
Exact mass
187.9796 Da
Melting point
101.5 °C
Boiling point
270 °C
logP
2.76Crippen estimate
Polar surface area
17.1 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
2

Identifiers

CAS number
937-20-2
SMILES
O=C(CCl)c1ccc(Cl)cc1
InChIKey
FWDFNLVLIXAOMX-UHFFFAOYSA-N
InChI
InChI=1S/C8H6Cl2O/c9-5-8(11)6-1-3-7(10)4-2-6/h1-4H,5H2

Weigh it out

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

Names and synonyms

14 names · show all
  • Ethanone, 2-chloro-1-(4-chlorophenyl)-
  • Acetophenone, 2,4′-dichloro-
  • 2-Chloro-1-(4-chlorophenyl)ethanone
  • p-Chlorophenacyl chloride
  • α-Chloro-p-chloroacetophenone
  • ω-Chloro-p-chloroacetophenone
  • 4-Chlorophenacyl chloride
  • Chloromethyl 4-chlorophenyl ketone
  • 2-Chloro-1-(4-chlorophenyl)-1-ethanone
  • 1-(4-Chlorophenyl)-2-chloroethanone
  • 2-Chloro-4′-chloroacetophenone
  • NSC 41669
  • α-Chloro-4-chloroacetophenone
  • 2-Chloro-1-(4′-chlorophenyl)-ethanone

Work with 2,4′-Dichloroacetophenone

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

3-Chloro-1-(4-chlorophenyl)-1-propanone3946-29-066 % similar Phenacyl chloride532-27-463 % similar 1-(4-Bromophenyl)-2-chloroethanone4209-02-362 % similar 2-Chloro-1-(4-methylphenyl)ethanone4209-24-962 % similar 2-Chloro-4′-fluoroacetophenone456-04-262 % similar 2′-Bromo-4-chloroacetophenone536-38-962 % similar 1-(4-Chlorophenyl)-1-propanone6285-05-862 % similar 2-Chloro-1-(4-hydroxyphenyl)ethanone6305-04-062 % similar

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

Same formula

3',5'-Dichloroacetophenone14401-72-0 1-(2,6-Dichlorophenyl)ethanone2040-05-3 2′,4′-Dichloroacetophenone2234-16-4 1-(2,5-Dichlorophenyl)ethanone2476-37-1 4-Chlorobenzeneacetyl chloride25026-34-0 3′,4′-Dichloroacetophenone2642-63-9 2,2-Dichloroacetophenone2648-61-5 α-Chlorobenzeneacetyl chloride2912-62-1

Elsewhere

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