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Merck
CN

518409

3-Chloro-2-methylbenzoic acid

98%

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About This Item

Linear Formula:
ClC6H3(CH3)CO2H
CAS Number:
Molecular Weight:
170.59
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
MDL number:
Assay:
98%
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InChI

1S/C8H7ClO2/c1-5-6(8(10)11)3-2-4-7(5)9/h2-4H,1H3,(H,10,11)

SMILES string

Cc1c(Cl)cccc1C(O)=O

InChI key

HXGHMCLCSPQMOR-UHFFFAOYSA-N

assay

98%

mp

163-166 °C (lit.)

pictograms

Exclamation mark

signalword

Warning

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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Monomers and Polymers. III. A New Synthesis for α-Methylstyrenes1, 2.
Bachman GB and Hellman HM.
Journal of the American Chemical Society, 70(5), 1772-1774 (1948)
F K Higson et al.
Applied and environmental microbiology, 58(8), 2501-2504 (1992-08-01)
Pseudomonas cepacia MB2 grew on 3-chloro-2-methylbenzoate as a sole carbon source by metabolism through the meta fission pathway with the subsequent liberation of chloride. meta pyrocatechase activity in cell extracts was induced strongly by 3-chloro-2-methylbenzoate, but not by nongrowth analogs
Guangxin Xia et al.
European journal of medicinal chemistry, 62, 1-10 (2013-01-29)
The potential roles of 11β-HSD1 inhibitors in metabolic syndrome, T2D and obesity were well established and currently several classes of 11β-HSD1 inhibitors have been developed as promising agents against metabolic diseases. To find potent compounds with good pharmacokinetics, we used

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