3-Bromo-5-chlorobenzaldehyde

C₇H₄BrClOCAS 188813-05-0219.46 g/mol

Open in Covalent MOL file

Aldehyde Aryl halide

Properties

Molecular formula: C₇H₄BrClO
Molar mass: 219.46 g/mol
Exact mass: 217.9134 Da
logP: 2.92Crippen estimate
Polar surface area: 17.1 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 1

Identifiers

CAS number

188813-05-0

SMILES

O=Cc1cc(Cl)cc(Br)c1

InChIKey

JGMGDYUVFBBCEQ-UHFFFAOYSA-N

InChI

InChI=1S/C7H4BrClO/c8-6-1-5(4-10)2-7(9)3-6/h1-4H

Weigh it out

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

Names and synonyms

2 names

Benzaldehyde, 3-bromo-5-chloro-
5-Bromo-3-chlorobenzaldehyde

Work with 3-Bromo-5-chlorobenzaldehyde

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

3,5-Dichlorobenzaldehyde10203-08-468 % similar 5-Bromoisophthalaldehyde120173-41-368 % similar 3,5-Dibromobenzaldehyde56990-02-468 % similar Bromo-3,5-dichlorobenzene19752-55-756 % similar 3-Bromobenzaldehyde3132-99-853 % similar 4-Bromobenzaldehyde1122-91-450 % similar 3-Bromo-5-methoxybenzaldehyde262450-65-750 % similar 3-Bromo-5-chlorophenol56962-04-050 % similar

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

Same formula

4-Bromo-3-chlorobenzaldehyde120077-69-2 3-Bromobenzoyl chloride1711-09-7 5-Bromo-2-chlorobenzaldehyde189628-37-3 4-Bromobenzoyl chloride586-75-4 2-Bromobenzoyl chloride7154-66-7

Elsewhere

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