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CAS Number: 942631-65-4
1-isopropyl-1H-pyrazole-3-carboxylic acid

Structure

1-isopropyl-1H-pyrazole-3-carboxylic acid
Name: 1-isopropyl-1H-pyrazole-3-carboxylic acid
Synonyms:
General Information
Product Number: 942631654
CAS Registry Number: 942631-65-4
Name:
        1H-​Pyrazole-​3-​carboxylic acid, 1-​(1-​methylethyl)​-
 
Chemical Formula: C7H10N2O2
Exact Mass: 154.07
Molecular Weight: 154.17
m/z: 154.07 (100.0%), 155.08 (7.8%)
Elemental Analysis: C, 54.54; H, 6.54; N, 18.17; O, 20.76
 
InChI: InChI=1S/C7H10N2O2/c1-5(2)9-4-3-6(8-9)7(10)11/h3-5H,1-2H3,(H,10,11)
InChIKey: NZOZNIDXTXBUDN-UHFFFAOYSA-N
Canonical SMILES : CC(C)N1C=CC(=N1)C(=O)O

Specification

98%

References

PCT Int. Appl. (2013), WO 2013170112 A1 20131114. 

PCT Int. Appl. (2011), WO 2011063502 A1 20110603.  

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