chempirical

Cyclopropanecarbonyl chloride

C4H5ClOCAS 4023-34-1104.53 g/mol

Open in Covalent MOL file
OCl
Acyl halide

Properties

Molecular formula
C4H5ClO
Molar mass
104.53 g/mol
Exact mass
104.0029 Da
Melting point
77.5–78.5 °C
Boiling point
109–112 °C
logP
1.16Crippen estimate
Polar surface area
17.1 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
1

Identifiers

CAS number
4023-34-1
SMILES
O=C(Cl)C1CC1
InChIKey
ZOOSILUVXHVRJE-UHFFFAOYSA-N
InChI
InChI=1S/C4H5ClO/c5-4(6)3-1-2-3/h3H,1-2H2

Weigh it out

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

Names and synonyms

4 names
  • Cyclopropylcarbonyl chloride
  • Cyclopropanecarboxylic acid chloride
  • Cyclopropanoyl chloride
  • Cyclopropylcarboxylic acid chloride

Work with Cyclopropanecarbonyl chloride

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

Cyclopentanecarbonyl chloride4524-93-078 % similar Cyclobutanecarbonyl chloride5006-22-478 % similar Cyclohexanecarbonyl chloride2719-27-974 % similar 2-Propylpentanoyl chloride2936-08-567 % similar 2-Ethylbutyryl chloride2736-40-557 % similar 1-Acetyl-4-piperidinecarbonyl chloride59084-16-152 % similar 2-Ethylhexanoyl chloride760-67-848 % similar Dichloroacetyl chloride79-36-745 % similar

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

Same formula

2-Butenoyl chloride10487-71-5 trans-Crotonyl chloride625-35-4 Methacryloyl chloride920-46-7

Elsewhere

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