2-Chloro-1-(1-chlorocyclopropyl)ethanone

C₅H₆Cl₂OCAS 120983-72-4153.00 g/mol

Open in Covalent MOL file

Alkyl halide Ketone

Properties

Molecular formula: C₅H₆Cl₂O
Molar mass: 153.00 g/mol
Exact mass: 151.9796 Da
logP: 1.57Crippen estimate
Polar surface area: 17.1 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 2

Identifiers

CAS number

120983-72-4

SMILES

O=C(CCl)C1(Cl)CC1

InChIKey

VHHGLRZRRBYTNE-UHFFFAOYSA-N

InChI

InChI=1S/C5H6Cl2O/c6-3-4(8)5(7)1-2-5/h1-3H2

Weigh it out

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

Names and synonyms

2 names

Ethanone, 2-chloro-1-(1-chlorocyclopropyl)-
1-Chloro-1-chloroacetylcyclopropane

Work with 2-Chloro-1-(1-chlorocyclopropyl)ethanone

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

1,1,1,3-Tetrachloroacetone16995-35-057 % similar 1-Chloropinacolone13547-70-150 % similar Chloroacetyl chloride79-04-932 % similar Chloro-N,N-diethylacetamide2315-36-831 % similar Chloroacetic anhydride541-88-831 % similar Chloroacetone78-95-531 % similar Chloroacetic acid79-11-831 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook