2-Bromo-5-chlorobenzaldehyde

C₇H₄BrClOCAS 174265-12-4219.46 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

174265-12-4

SMILES

C1=CC(=C(C=C1Cl)C=O)Br

InChIKey

IIISHLMCTDMUHH-UHFFFAOYSA-N

InChI

InChI=1S/C7H4BrClO/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.

Work with 2-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

2,5-Dichlorobenzaldehyde6361-23-560 % similar 2-Bromo-5-hydroxybenzaldehyde2973-80-056 % similar 5-Chlorosalicylaldehyde635-93-856 % similar 2-Bromo-5-fluorobenzaldehyde94569-84-356 % similar 3-Bromo-5-chlorosalicylaldehyde19652-32-556 % similar 5-Chloro-2-methoxybenzaldehyde7035-09-856 % similar 2,4-Dichlorobenzaldehyde874-42-055 % similar 2-Bromobenzaldehyde6630-33-752 % similar

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

Same formula

4-Bromo-3-chlorobenzaldehyde120077-69-2 4-Bromo-2-chlorobenzaldehyde158435-41-7 3-Bromobenzoyl chloride1711-09-7 3-Bromo-5-chlorobenzaldehyde188813-05-0 5-Bromo-2-chlorobenzaldehyde189628-37-3 4-Bromobenzoyl chloride586-75-4 2-Bromobenzoyl chloride7154-66-7

Elsewhere

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