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CAS Number: 153203-53-3
methyl 3-chloro-5-methylbenzoate

Structure

 methyl 3-chloro-5-methylbenzoate
Name: methyl 3-chloro-5-methylbenzoate
Synonyms:
General Information
Product Number: 153203533

CAS Registry Number 153203-53-3
Name:
Benzoic acid, 3-?chloro-?5-?methyl-?, methyl ester

 

Chemical Formula: C9H9ClO2
Exact Mass: 184.03
Molecular Weight: 184.62
m/z: 184.03 (100.0%), 186.03 (32.4%), 185.03 (9.8%), 187.03 (3.2%)

 

InChI:InChI=1S/C9H9ClO2/c1-6-3-7(9(11)12-2)5-8(10)4-6/h3-5H,1-2H3

InChI Key:KEVTYTACXUBFFR-UHFFFAOYSA-N

Canonical SMILES:CC1=CC(=CC(=C1)C(=O)OC)Cl

Specification

98%
References

(1) Murphy, Jaclyn M.; Journal of the American Chemical Society 2007, V129(50), P15434-15435 CAPLUS
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