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CAS Number: 27006-82-2
5-chloro-1,3-dimethyl-1H-pyrazole-4-carboxylic acid

Structure

 5-chloro-1,3-dimethyl-1H-pyrazole-4-carboxylic acid
Name: 5-chloro-1,3-dimethyl-1H-pyrazole-4-carboxylic acid
Synonyms:
General Information
Product Number: 27006822

CAS Registry Number 27006-82-2
Name:
1H-?Pyrazole-?4-?carboxylic acid, 5-?chloro-?1,?3-?dimethyl-
Pyrazole-4-carboxylic acid, 5-chloro-1,3-dimethyl- (8CI)
5-Chloro-1,3-dimethyl-1H-pyrazole-4-carboxylic acid
5-Chloro-1,3-dimethyl-4-pyrazolecarboxylic acid

 

Chemical Formula: C6H7ClN2O2
Exact Mass: 174.02
Molecular Weight: 174.58
m/z: 174.02 (100.0%), 176.02 (32.4%), 175.02 (7.3%), 177.02 (2.1%)

 

InChI:InChI=1S/C6H7ClN2O2/c1-3-4(6(10)11)5(7)9(2)8-3/h1-2H3,(H,10,11)

InChI Key:RRWQERXMLIEDKJ-UHFFFAOYSA-N

Canonical SMILES:CC1=NN(C(=C1C(=O)O)Cl)C

Specification

98%
References

PCT Int. Appl. (2016), WO 2016171142 A1 20161027.

PCT Int. Appl. (2010), WO 2010134014 A1 20101125. 
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