2-Bromobenzyl alcohol

C7H7BrOCAS 18982-54-2187.04 g/mol

Open in Covalent MOL file
HOBr
AlcoholAryl 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 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
1

Hazards

Warning
Irritant (GHS07)

Aggregated from 43 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P264+P265, P270, P280, P301+P317, P305+P351+P338, P330, P337+P317, P501

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-fluorobenzyl Alcohol261723-32-459 % similar 3-Bromo-2-methylbenzenemethanol83647-43-259 % similar 3-(2-Bromo-phenyl)-propan-1-ol52221-92-856 % similar 2,4-Dibromobenzenemethanol666747-06-456 % similar 2-Bromobenzyl bromide3433-80-554 % similar (3-Bromopyridin-4-yl)methanol146679-66-554 % 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 2-Bromo-3-methyl-phenol22061-78-5 4-Bromo-2-methylphenol2362-12-1 3-Bromoanisole2398-37-0 5-Bromo-2-methylphenol36138-76-8

Elsewhere

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