2-Bromo-6-methylbenzoic acid
Properties
- Molecular formula
- C8H7BrO2
- Molar mass
- 215.05 g/mol
- Exact mass
- 213.9629 Da
- logP
- 2.46Crippen estimate
- Polar surface area
- 37.3 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 1
Hazards
Danger
- H301 Toxic if swallowed87% of notifiers
- H315 Causes skin irritation15.2% of notifiers
- H319 Causes serious eye irritation15.2% of notifiers
- H335 May cause respiratory irritation13% of notifiers
Aggregated from 46 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P270, P271, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
90259-31-7SMILES
CC1=C(C(=CC=C1)Br)C(=O)OInChIKey
ICXBPDJQFPIBSS-UHFFFAOYSA-NInChI
InChI=1S/C8H7BrO2/c1-5-3-2-4-6(9)7(5)8(10)11/h2-4H,1H3,(H,10,11)Weigh it out
Type any one amount. The others follow from the molar mass.
Work with 2-Bromo-6-methylbenzoic acid
Similar compounds
2,6-Dimethylbenzoic acid632-46-275 % similar
2,6-Dibromobenzoic acid601-84-371 % similar
2-Chloro-6-methylbenzoic acid21327-86-664 % similar
6-Methylanthranilic acid4389-50-862 % similar
2-Fluoro-6-methylbenzoic acid90259-27-162 % similar
2-Amino-6-bromobenzoic acid20776-48-159 % similar
2-Bromo-6-fluorobenzoic acid2252-37-159 % similar
2-Bromo-6-methoxybenzoic acid31786-45-558 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds
Same formula
5′-Bromo-2′-hydroxyacetophenone1450-75-5
1-(3-Bromo-2-hydroxyphenyl)ethanone1836-05-1
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3-Bromophenylacetic acid1878-67-7
4-Bromophenylacetic acid1878-68-8
2-Bromo-1-(2-hydroxyphenyl)ethanone2491-36-3
2-Bromo-1-(3-hydroxyphenyl)ethanone2491-37-4
2-Bromo-1-(4-hydroxyphenyl)ethanone2491-38-5