chempirical

2-Bromo-6-chlorobenzaldehyde

C7H4BrClOCAS 64622-16-8219.46 g/mol

Open in Covalent MOL file
BrOCl
AldehydeAryl 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 Ų
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. Search the SDS library

Identifiers

CAS number
64622-16-8
SMILES
C1=CC(=C(C(=C1)Br)C=O)Cl
InChIKey
NUGMENVSVAURGO-UHFFFAOYSA-N
InChI
InChI=1S/C7H4BrClO/c8-6-2-1-3-7(9)5(6)4-10/h1-4H

Weigh it out

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

Names and synonyms

1 names
  • Akos msc-0782

Work with 2-Bromo-6-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

2,6-Dibromobenzaldehyde67713-23-971 % similar 2,6-Dichlorobenzaldehyde83-38-571 % similar 2-Chloro-6-hydroxybenzaldehyde18362-30-659 % similar 2-Bromo-6-hydroxybenzaldehyde22532-61-259 % similar 2-Chloro-6-methylbenzaldehyde1194-64-557 % similar 2-Bromo-6-fluorobenzaldehyde360575-28-657 % similar 2-Chloro-6-fluorobenzaldehyde387-45-157 % similar 3-Bromo-4-chloro-benzaldehyde86265-88-555 % 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 2-Bromo-5-chlorobenzaldehyde174265-12-4 3-Bromo-5-chlorobenzaldehyde188813-05-0 5-Bromo-2-chlorobenzaldehyde189628-37-3 4-Bromobenzoyl chloride586-75-4 2-Bromobenzoyl chloride7154-66-7

Elsewhere

PubChem CAS Common Chemistry NIST WebBook