5-Bromo-2-fluorobenzaldehyde

C₇H₄BrFOCAS 93777-26-5203.01 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

93777-26-5

SMILES

O=Cc1cc(Br)ccc1F

InChIKey

MMFGGDVQLQQQRX-UHFFFAOYSA-N

InChI

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

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

Names and synonyms

3 names

Benzaldehyde, 5-bromo-2-fluoro-
3-Bromo-6-fluorobenzaldehyde
2-Fluoro-5-bromobenzaldehyde

Work with 5-Bromo-2-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-Fluoro-5-iodobenzaldehyde146137-76-056 % similar 5-Bromosalicylaldehyde1761-61-156 % similar 5-Bromo-2-chlorobenzaldehyde189628-37-356 % similar 2-Amino-5-bromobenzaldehyde29124-57-056 % similar 1-Bromo-3,4-difluorobenzene348-61-854 % similar 4-Bromo-2-hydroxybenzaldehyde22532-62-353 % similar 5-Bromo-2-methoxybenzaldehyde25016-01-753 % similar 4-Bromo-2-(trifluoromethyl)benzaldehyde861928-27-053 % 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 2-Bromo-5-fluorobenzaldehyde94569-84-3

Elsewhere

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