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CAS Number: 92933-47-6
3-isopropyl-2,3-dihydro-1H-pyrazole-3-carboxylic acid

Structure

3-isopropyl-2,3-dihydro-1H-pyrazole-3-carboxylic acid
Name: 3-isopropyl-2,3-dihydro-1H-pyrazole-3-carboxylic acid
Synonyms:
General Information
Product Number: 92933476

CAS Registry Number 92933-47-6
Name:
1H-​Pyrazole-​3-​carboxylic acid, 5-​(1-​methylethyl)​-
3-Isopropyl-2H-pyrazole-3-carboxylic acid
5-Isopropyl-1H-pyrazole-3-carboxylic acid

 

Chemical Formula: C7H12N2O2
Exact Mass: 156.09
Molecular Weight: 156.18
m/z: 156.09 (100.0%), 157.09 (8.4%)

 

InChI:InChI=1S/C7H10N2O2/c1-4(2)5-3-6(7(10)11)9-8-5/h3-4H,1-2H3,(H,8,9)(H,10,11)

InChI Key:CHWXKAHFWLSLOQ-UHFFFAOYSA-N

Canonical SMILES:CC(C)C1=CC(=NN1)C(=O)O

 

Thermal Properties Value Condition Note
Melting Point 150-152 °C   (1)CAS

Specification

98%

References
  1. (1) van Herk, T.; Journal of Medicinal Chemistry 2003, V46(18), P3945-3951 CAPLUS
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