4-Bromo-2-hydroxybenzaldehyde

C₇H₅BrO₂CAS 22532-62-3201.02 g/mol

Open in Covalent MOL file

Aldehyde Aryl halide Phenol

Properties

Molecular formula: C₇H₅BrO₂
Molar mass: 201.02 g/mol
Exact mass: 199.9473 Da
Melting point: 52 °C
Boiling point: 48–52 °C (at 0.04 Torr)
logP: 1.97Crippen estimate
Polar surface area: 37.3 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 1

Identifiers

CAS number

22532-62-3

SMILES

O=Cc1ccc(Br)cc1O

InChIKey

HXTWKHXDFATMSP-UHFFFAOYSA-N

InChI

InChI=1S/C7H5BrO2/c8-6-2-1-5(4-9)7(10)3-6/h1-4,10H

Weigh it out

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

Names and synonyms

4 names

Benzaldehyde, 4-bromo-2-hydroxy-
Salicylaldehyde, 4-bromo-
4-Bromosalicylaldehyde
2-Hydroxy-4-bromobenzaldehyde

Work with 4-Bromo-2-hydroxybenzaldehyde

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

2,4-Dihydroxybenzaldehyde95-01-264 % similar 4-Bromo-2-fluorobenzaldehyde57848-46-158 % similar 4-Bromocatechol17345-77-656 % similar 2-Hydroxy-4-methylbenzaldehyde698-27-155 % similar 4-Bromo-2-(trifluoromethyl)benzaldehyde861928-27-055 % similar 2,4,5-Trihydroxybenzaldehyde35094-87-254 % similar 5-Bromo-2-chlorobenzaldehyde189628-37-353 % similar 2-Amino-5-bromobenzaldehyde29124-57-053 % similar

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

Same formula

5-Bromosalicylaldehyde1761-61-1 2-Bromo-4-hydroxybenzaldehyde22532-60-1 5-Bromo-1,3-benzodioxole2635-13-4 3-Bromo-4-hydroxybenzaldehyde2973-78-6 2-Bromo-5-hydroxybenzaldehyde2973-80-0 3-Bromobenzoic acid585-76-2 4-Bromobenzoic acid586-76-5 2-Bromobenzoic acid88-65-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook