(5-Bromo-2-chlorophenyl)methanol

C7H6BrClOCAS 149965-40-2221.48 g/mol

Open in Covalent MOL file
BrOHCl
AlcoholAryl halide

Properties

Molecular formula
C7H6BrClO
Molar mass
221.48 g/mol
Exact mass
219.9291 Da
logP
2.59Crippen estimate
Polar surface area
20.2 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
1

Hazards

Warning
Irritant (GHS07)

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

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
149965-40-2
SMILES
C1=CC(=C(C=C1Br)CO)Cl
InChIKey
SCHBQPIVMBDOQF-UHFFFAOYSA-N
InChI
InChI=1S/C7H6BrClO/c8-6-1-2-7(9)5(3-6)4-10/h1-3,10H,4H2

Weigh it out

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

Names and synonyms

1 names
  • 5-Bromo-2-chlorobenzyl alcohol 97

Work with (5-Bromo-2-chlorophenyl)methanol

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

2,5-Dichlorobenzylic alcohol34145-05-660 % similar 4-(5-Bromo-2-chlorobenzyl)phenol864070-18-859 % similar 5-Bromo-2-hydroxybenzyl alcohol2316-64-558 % similar 2-Chloro-5-fluorobenzenemethanol261762-59-856 % similar 5-Bromo-2-fluorobenzenemethanol99725-13-056 % similar 2-Chlorobenzyl alcohol17849-38-655 % similar 2,4-Dibromobenzenemethanol666747-06-455 % similar 4-Bromo-1,2-dichlorobenzene18282-59-254 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

5-Bromo-2-chloroanisole16817-43-9 1-Bromo-4-chloro-2-methoxybenzene174913-09-8 3-Bromo-4-chloroanisole2732-80-1 1-Bromo-2-chloro-4-methoxybenzene50638-46-5 2-Bromo-4-chloroanisole60633-25-2 4-Bromo-6-chloro-2-cresol7530-27-0

Elsewhere

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