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CAS Number: 49633-25-2
3-isopropyl-1H-pyrazole

Structure

3-isopropyl-1H-pyrazole
Name: 3-isopropyl-1H-pyrazole
Synonyms:
General Information
Product Number: 49633252
CAS Registry Number: 49633-25-2
Name:
        1H-​Pyrazole, 3-​(1-​methylethyl)​-
        Pyrazole, 3(or 5)​-​isopropyl- (7CI); 3-​Isopropyl-​1H-​pyrazole; 3-​Isopropylpyrazole  
        Deleted CAS Registry Numbers: 5782-​67-​2, 1527514-​89-​1
 
Chemical Formula: C6H10N2
Exact Mass: 110.08
Molecular Weight: 110.16
m/z: 110.08 (100.0%), 111.09 (6.6%)
Elemental Analysis: C, 65.42; H, 9.15; N, 25.43
 
InChI: InChI=1S/C6H10N2/c1-5(2)6-3-4-7-8-6/h3-5H,1-2H3,(H,7,8)
InChIKey: ZICRALLMHKILDG-UHFFFAOYSA-N
Canonical SMILES : CC(C)C1=CC=NN1
 
Thermal Properties Value Condition Note
Boiling Point 115 °C Press: 12 Torr (1)CAS

Specification

98%

References

  • (1) Martin, James C.; US 3141880 1964 CAPLUS
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