2-Bromo-4-fluorobenzaldehyde

C₇H₄BrFOCAS 59142-68-6203.01 g/mol

Open in Covalent MOL file

Aldehyde Aryl halide

Properties

Molecular formula: C₇H₄BrFO
Molar mass: 203.01 g/mol
Exact mass: 201.9430 Da
logP: 2.40Crippen estimate
Polar surface area: 17.1 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 1

Identifiers

CAS number

59142-68-6

SMILES

O=Cc1ccc(F)cc1Br

InChIKey

OPZDXMCOWFPQPE-UHFFFAOYSA-N

InChI

InChI=1S/C7H4BrFO/c8-7-3-6(9)2-1-5(7)4-10/h1-4H

Weigh it out

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Names and synonyms

2 names

Benzaldehyde, 2-bromo-4-fluoro-
4-Fluoro-2-bromobenzaldehyde

Work with 2-Bromo-4-fluorobenzaldehyde

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

2,4-Difluorobenzaldehyde1550-35-260 % similar 2-Bromo-4-hydroxybenzaldehyde22532-60-156 % similar 2-Chloro-4-fluorobenzaldehyde84194-36-556 % similar 2-Bromo-4-(trifluoromethyl)benzaldehyde85118-24-756 % similar 1,2-Dibromo-4-fluorobenzene2369-37-154 % similar 2-Bromobenzaldehyde6630-33-752 % similar 2-Bromo-4-fluorophenol496-69-552 % similar 5-Fluoro-2-methoxybenzaldehyde19415-51-151 % similar

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

Same formula

4-Bromo-2-fluorobenzaldehyde57848-46-1 3-Bromo-4-fluorobenzaldehyde77771-02-9 5-Bromo-2-fluorobenzaldehyde93777-26-5 2-Bromo-5-fluorobenzaldehyde94569-84-3

Elsewhere

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