3-(Bromomethyl)phenylboronic acid
Properties
- Molecular formula
- C7H8BBrO2
- Molar mass
- 214.85 g/mol
- Exact mass
- 213.9801 Da
- Melting point
- 214–216 °C
- logP
- 0.26Crippen estimate
- Polar surface area
- 40.5 Ų
- H-bond donors / acceptors
- 2 / 2
- Rotatable bonds
- 2
Hazards
Danger
- H314 Causes severe skin burns and eye damage14.9% of notifiers
- H315 Causes skin irritation85.1% of notifiers
- H319 Causes serious eye irritation85.1% of notifiers
- H335 May cause respiratory irritation85.1% of notifiers
Aggregated from 47 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P260, P261, P264, P264+P265, P271, P280, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P319, P321, P332+P317, P337+P317, P362+P364, P363, P403+P233, P405, P501
Identifiers
CAS number
51323-43-4SMILES
OB(O)c1cccc(CBr)c1InChIKey
ATRFDLFMCLYROQ-UHFFFAOYSA-NInChI
InChI=1S/C7H8BBrO2/c9-5-6-2-1-3-7(4-6)8(10)11/h1-4,10-11H,5H2Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
7 names
- Boronic acid, B-[3-(bromomethyl)phenyl]-
- Boronic acid, [3-(bromomethyl)phenyl]-
- m-Tolueneboronic acid, α-bromo-
- B-[3-(Bromomethyl)phenyl]boronic acid
- m-Bromomethylphenylboric acid
- m-Boronobenzyl bromide
- 3-(Bromomethyl)benzeneboronic acid
Work with 3-(Bromomethyl)phenylboronic acid
Similar compounds
(3-Hydroxymethyl)phenylboronic acid87199-15-363 % similar
3-Ethylphenylboronic acid90555-65-061 % similar
1,3-Benzenediboronic acid4612-28-658 % similar
1,3-Bis(bromomethyl)benzene626-15-358 % similar
3-Methoxymethylphenylboronic acid142273-84-556 % similar
3-Cyanomethylphenylboronic acid220616-39-756 % similar
(3-Aminomethylphenyl)boronic acid hydrochloride352525-94-156 % similar
3-Fluorophenylboronic acid768-35-453 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.