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Merck
CN

264660

3-Bromo-4-methylbenzoic acid

technical grade, 85%

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About This Item

Linear Formula:
Br(CH3)C6H3COOH
CAS Number:
Molecular Weight:
215.04
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
EC Number:
231-712-1
MDL number:
Assay:
85%
Form:
solid
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grade

technical grade

assay

85%

form

solid

mp

200-202 °C (lit.), 200-204 °C

functional group

bromo, carboxylic acid

SMILES string

Cc1ccc(cc1Br)C(O)=O

InChI

1S/C8H7BrO2/c1-5-2-3-6(8(10)11)4-7(5)9/h2-4H,1H3,(H,10,11)

InChI key

ZFJOMUKPDWNRFI-UHFFFAOYSA-N

Application

3-Bromo-4-methylbenzoic acid has been used in the synthesis of:
  • biphenyl amides
  • 2-benzazepine-4-acetic acid derivative, as an analog of the potent, nonpeptide GPIIb/IIIa antagonist
  • O-spiro C-aryl glucosides


pictograms

Skull and crossbones

signalword

Danger

Hazard Classifications

Acute Tox. 3 Oral - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

Storage Class

6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Faceshields, Gloves



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