2-Bromobenzyl alcohol

C₇H₇BrOCAS 18982-54-2187.04 g/mol

Open in Covalent MOL file

Alcohol Aryl halide

Properties

Molecular formula: C₇H₇BrO
Molar mass: 187.04 g/mol
Exact mass: 185.9680 Da
Melting point: 79 °C
logP: 1.94Crippen estimate
Polar surface area: 20.2 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 1

Identifiers

CAS number

18982-54-2

SMILES

OCc1ccccc1Br

InChIKey

IOWGHQGLUMEZKG-UHFFFAOYSA-N

InChI

InChI=1S/C7H7BrO/c8-7-4-2-1-3-6(7)5-9/h1-4,9H,5H2

Weigh it out

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

Names and synonyms

8 names

Benzenemethanol, 2-bromo-
Benzyl alcohol, o-bromo-
2-Bromobenzenemethanol
o-Bromobenzyl alcohol
1-Bromo-2-(hydroxymethyl)benzene
2-Bromophenylmethanol
2-Hydroxymethyl-1-bromobenzene
2-(Hydroxymethyl)phenyl bromide

Work with 2-Bromobenzyl alcohol

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

1,2-Benzenedimethanol612-14-665 % similar 2-Bromobenzeneethanol1074-16-460 % similar 3-Bromo-2-methylbenzenemethanol83647-43-259 % similar 2,4-Dibromobenzenemethanol666747-06-456 % similar 2-Bromobenzyl bromide3433-80-554 % similar 1-Bromo-2-ethylbenzene1973-22-452 % similar Salicyl alcohol90-01-752 % similar 2-Bromo-5-fluorobenzenemethanol202865-66-552 % similar

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

Same formula

4-Bromoanisole104-92-7 2-Bromo-6-methylphenol13319-71-6 4-Bromo-3-methylphenol14472-14-1 3-Bromobenzenemethanol15852-73-0 4-Bromo-2-methylphenol2362-12-1 3-Bromoanisole2398-37-0 2-Bromoanisole578-57-4 2-Bromo-4-methylphenol6627-55-0

Elsewhere

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