3,5-Dibromo-4-hydroxybenzaldehyde

C₇H₄Br₂O₂CAS 2973-77-5279.91 g/mol

Open in Covalent MOL file

Aldehyde Aryl halide Phenol

Properties

Molecular formula: C₇H₄Br₂O₂
Molar mass: 279.91 g/mol
Exact mass: 277.8578 Da
Melting point: 185 °C
logP: 2.73Crippen estimate
Polar surface area: 37.3 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 1

Identifiers

CAS number

2973-77-5

SMILES

O=Cc1cc(Br)c(O)c(Br)c1

InChIKey

SXRHGLQCOLNZPT-UHFFFAOYSA-N

InChI

InChI=1S/C7H4Br2O2/c8-5-1-4(3-10)2-6(9)7(5)11/h1-3,11H

Weigh it out

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

Names and synonyms

3 names

Benzaldehyde, 3,5-dibromo-4-hydroxy-
4-Hydroxy-3,5-dibromobenzaldehyde
NSC 72944

Work with 3,5-Dibromo-4-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

5-Bromovanillin2973-76-471 % similar 3-Bromo-4-hydroxybenzaldehyde2973-78-662 % similar 3,4,5-Trihydroxybenzaldehyde13677-79-756 % similar 2,4,6-Tribromo-3-hydroxybenzaldehyde2737-22-655 % similar 3,5-Difluoro-4-hydroxybenzaldehyde118276-06-552 % similar 4-Hydroxy-3,5-diiodobenzaldehyde1948-40-952 % similar 3,5-Dimethyl-4-hydroxybenzaldehyde2233-18-352 % similar 3-Bromo-5-chlorosalicylaldehyde19652-32-552 % similar

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

Same formula

2,5-Dibromobenzoic acid610-71-9 2,4-Dibromobenzoic acid611-00-7 3,5-Dibromobenzoic acid618-58-6 3,5-Dibromosalicylaldehyde90-59-5

Elsewhere

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