2-Bromo-1-cyclopropyl-2-(2-fluorophenyl)ethanone

C₁₁H₁₀BrFOCAS 204205-33-4257.10 g/mol

Open in Covalent MOL file

Alkyl halide Aryl halide Ketone

Properties

Molecular formula: C₁₁H₁₀BrFO
Molar mass: 257.10 g/mol
Exact mass: 255.9899 Da
logP: 3.24Crippen estimate
Polar surface area: 17.1 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 3

Hazards

Warning

H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers

Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, P362+P364

Identifiers

CAS number

204205-33-4

SMILES

C1CC1C(=O)C(C2=CC=CC=C2F)Br

InChIKey

LMCZCCDXOZGIND-UHFFFAOYSA-N

InChI

InChI=1S/C11H10BrFO/c12-10(11(14)7-5-6-7)8-3-1-2-4-9(8)13/h1-4,7,10H,5-6H2

Weigh it out

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Names and synonyms

1 names

2-Bromo-2-(2-fluorophenyl)-1-cyclopropylethanone

Work with 2-Bromo-1-cyclopropyl-2-(2-fluorophenyl)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

5-[2-Cyclopropyl-1-(2-fluorophenyl)-2-oxoethyl]-5,6,7,7A-tetrahydrothieno[3,2-C]pyridin-2(4H)-one150322-38-645 % similar Cyclopropyl 2-fluorobenzyl ketone150322-73-944 % similar (2-Fluorophenyl)glycine2343-27-340 % similar Dicyclopropyl ketone1121-37-539 % similar 2-(2-Fluorophenyl)pyrrolidine72216-04-738 % similar 1-(Dichloromethyl)-2-fluorobenzene320-65-038 % similar Prasugrel150322-43-338 % similar 3-Benzyl-3-azabicyclo(3.2.1)octan-8-one83507-33-937 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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