2-Bromo-5-fluorobenzaldehyde

C₇H₄BrFOCAS 94569-84-3203.01 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
Melting point: 53–55 °C
logP: 2.40Crippen estimate
Polar surface area: 17.1 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 1

Identifiers

CAS number

94569-84-3

SMILES

O=Cc1cc(F)ccc1Br

InChIKey

CJUCIKJLMFVWIS-UHFFFAOYSA-N

InChI

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

Weigh it out

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

Names and synonyms

2 names

Benzaldehyde, 2-bromo-5-fluoro-
5-Fluoro-2-bromobenzaldehyde

Work with 2-Bromo-5-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-Bromo-5-hydroxybenzaldehyde2973-80-056 % similar 2-Bromo-5-(trifluoromethyl)benzaldehyde102684-91-356 % similar 5-Fluoro-2-methoxybenzaldehyde19415-51-156 % similar 2,4-Difluorobenzaldehyde1550-35-255 % similar 3-(2-Bromo-5-fluorophenyl)-2-propenoic acid202865-70-154 % similar 1,2-Dibromo-4-fluorobenzene2369-37-154 % similar 5-Fluoro-2-(trifluoromethyl)benzaldehyde90381-08-153 % similar 2-Bromobenzaldehyde6630-33-752 % similar

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

Same formula

4-Bromo-2-fluorobenzaldehyde57848-46-1 2-Bromo-4-fluorobenzaldehyde59142-68-6 3-Bromo-4-fluorobenzaldehyde77771-02-9 5-Bromo-2-fluorobenzaldehyde93777-26-5

Elsewhere

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