2-Bromo-1-cyclopropylethan-1-one

C₅H₇BrOCAS 69267-75-0163.01 g/mol

Open in Covalent MOL file

Alkyl halide Ketone

Properties

Molecular formula: C₅H₇BrO
Molar mass: 163.01 g/mol
Exact mass: 161.9680 Da
logP: 1.36Crippen estimate
Polar surface area: 17.1 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 2

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

69267-75-0

SMILES

C1CC1C(=O)CBr

InChIKey

WCCCDMWRBVVYCQ-UHFFFAOYSA-N

InChI

InChI=1S/C5H7BrO/c6-3-5(7)4-1-2-4/h4H,1-3H2

Weigh it out

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

Names and synonyms

1 names

Ethanone, 2-bromo-1-cyclopropyl-

Work with 2-Bromo-1-cyclopropylethan-1-one

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

1,1,3-Tribromo-2-propanone3475-39-655 % similar 1-Bromo-3-methylbutan-2-one19967-55-652 % similar tert-Butyl 4-(2-Bromoacetyl)piperidine-1-carboxylate301221-79-446 % similar 3-Cyclopropyl-3-oxopropanenitrile118431-88-242 % similar Norcamphor497-38-138 % similar Dicyclopropyl ketone1121-37-538 % similar 1,4-Dibromo-2,3-butanedione6305-43-738 % similar 1,3-Dibromo-2-propanone816-39-738 % similar

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

Same formula

2-Bromocyclopentanone21943-50-0

Elsewhere

PubChem CAS Common Chemistry NIST WebBook