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About This Item
Linear Formula:
BrC6H3(CH3)CO2H
CAS Number:
Molecular Weight:
215.04
UNSPSC Code:
12352100
PubChem Substance ID:
EC Number:
231-713-7
MDL number:
Assay:
97%
InChI key
KWVXDZLVCISXIB-UHFFFAOYSA-N
InChI
1S/C8H7BrO2/c1-5-4-6(8(10)11)2-3-7(5)9/h2-4H,1H3,(H,10,11)
SMILES string
Cc1cc(ccc1Br)C(O)=O
assay
97%
mp
212-216 °C (lit.)
General description
4-Bromo-3-methylbenzoic acid can be prepared by the hydrolysis of 4-bromo-3-methylbenzonitrile.
Application
4-Bromo-3-methylbenzoic acid may be used in the preparation of following organic compounds:
- 4-bromo-3-methylbenzoyl chloride
- 4-bromo-3-methylbenzoic acid tert-butyl ester
- 4-bromo-N-methoxy-3,N-dimethylbenzamide
- 2-(4-bromo-3-methylphenyl)-4,5-dihydro-4,4-dimethyloxazole
signalword
Warning
hcodes
Hazard Classifications
Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
Storage Class
11 - Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
dust mask type N95 (US), Eyeshields, Gloves
Regulatory Information
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Synthesis of polysaccharide derivatives bearing bromobenzoate pendants for use as chiral auxiliaries.
Ikai T, et al.
Reactive functional Polymers, 82, 52-57 (2014)
End group-functionalization and synthesis of block-copolythiophenes by modified nickel initiators.
Smeets A, et al.
Macromolecules, 44(15), 6017-6025 (2011)
Benzimidazole derivatives bearing substituted biphenyls as hepatitis C virus NS5B RNA-dependent RNA polymerase inhibitors: structure-activity relationship studies and identification of a potent and highly selective inhibitor JTK-109.
Hirashima S, et al.
Journal of Medicinal Chemistry, 49(15), 4721-4736 (2006)
Polycyclic systems. Part 19. Synthesis of 8-isobutyl-10-methyl-11 H-indeno [2, 1-a] phenanthrene (second diels hydrocarbon), a minor dehydrogenation product of cholesterol.
Nasipuri D, et al.
Journal of the Chemical Society. Perkin Transactions 1, 3034-3036 (1979)
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