3-Bromo-4-hydroxybenzenemethanol

C₇H₇BrO₂CAS 29922-56-3203.03 g/mol

Open in Covalent MOL file

Alcohol Aryl halide Phenol

Properties

Molecular formula: C₇H₇BrO₂
Molar mass: 203.03 g/mol
Exact mass: 201.9629 Da
Melting point: 127–129 °C
logP: 1.65Crippen estimate
Polar surface area: 40.5 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 1

Identifiers

CAS number

29922-56-3

SMILES

OCc1ccc(O)c(Br)c1

InChIKey

HAFQFRJTRZBJJF-UHFFFAOYSA-N

InChI

InChI=1S/C7H7BrO2/c8-6-3-5(4-9)1-2-7(6)10/h1-3,9-10H,4H2

Weigh it out

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

Names and synonyms

4 names

Benzenemethanol, 3-bromo-4-hydroxy-
Benzyl alcohol, 3-bromo-4-hydroxy-
3-Bromo-4-hydroxybenzyl alcohol
2-Bromo-4-hydroxymethylphenol

Work with 3-Bromo-4-hydroxybenzenemethanol

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

3,4-Dihydroxybenzyl alcohol3897-89-063 % similar 3-Bromo-4-fluorobenzenemethanol77771-03-058 % similar 3-Bromo-4-hydroxyphenylacetic acid38692-80-754 % similar 2-Bromo-1,4-benzenediol583-69-752 % similar 2,4-Dibromophenol615-58-752 % similar Vanillyl alcohol498-00-050 % similar 3-Bromo-4-hydroxybenzonitrile2315-86-848 % similar 4-Amino-2-bromophenol16750-67-748 % similar

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

Same formula

4-Bromo-3-methoxyphenol102127-34-4 2-Bromo-4-methoxyphenol17332-11-5 5-Bromo-2-hydroxybenzyl alcohol2316-64-5 5-Bromo-2-methoxyphenol37942-01-1 2-Bromo-5-methoxyphenol63604-94-4

Elsewhere

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