2-Chloro-4-bromo-5-fluorobenzaldehyde

C₇H₃BrClFOCAS 1214386-29-4237.45 g/mol

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Aldehyde Aryl halide

Properties

Molecular formula: C₇H₃BrClFO
Molar mass: 237.45 g/mol
Exact mass: 235.9040 Da
logP: 3.05Crippen estimate
Polar surface area: 17.1 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 1

Hazards

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

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Identifiers

CAS number

1214386-29-4

SMILES

C1=C(C(=CC(=C1F)Br)Cl)C=O

InChIKey

XPEGZWLIWARWAA-UHFFFAOYSA-N

InChI

InChI=1S/C7H3BrClFO/c8-5-2-6(9)4(3-11)1-7(5)10/h1-3H

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Names and synonyms

1 names

4-Bromo-2-chloro-5-fluorobenzaldehyde

Work with 2-Chloro-4-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-Chloro-4,5-difluorobenzaldehyde165047-23-470 % similar 4-Bromo-2,5-difluorobenzaldehyde357405-75-568 % similar 4-Bromo-5-fluoro-2-methylbenzaldehyde861928-26-960 % similar 2-Bromo-4,5-difluorobenzaldehyde476620-54-959 % similar 4-Chloro-2,5-difluorobenzaldehyde879093-02-458 % similar 2-Chloro-4-fluoro-5-nitrobenzaldehyde99329-85-849 % similar 4-Bromo-2-chloro-5-fluorobenzoic acid177480-81-848 % similar 4-Bromo-3-fluorobenzaldehyde133059-43-547 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2-Bromo-5-fluorobenzoyl chloride111771-13-2 4-Bromo-2-fluorobenzoyl chloride151982-51-3 3-Bromo-4-fluorobenzoyl chloride672-75-3

Elsewhere

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