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CAS Number: 85290-80-8
ethyl 1-methyl-1H-pyrazole-4-carboxylate

Structure

ethyl 1-methyl-1H-pyrazole-4-carboxylate
Name: ethyl 1-methyl-1H-pyrazole-4-carboxylate
Synonyms:
General Information
Product Number: 85290808
CAS Registry Number: 85290-80-8
Name:
        1H-​Pyrazole-​4-​carboxylic acid, 1-​methyl-​, ethyl ester
        Ethyl 1-​methyl-​1H-​pyrazole-​4-​carboxylate; Ethyl 1-​methylpyrazole-​4-​carboxylate 
 
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/c1-3-11-7(10)6-4-8-9(2)5-6/h4-5H,3H2,1-2H3
InChIKey: GXKQVOXCQOQZED-UHFFFAOYSA-N
Canonical SMILES : CCOC(=O)C1=CN(N=C1)C
 
Thermal Properties Value Condition Note
Boiling Point 81-83 °C Press: 0.2 Torr (1)IC
 

Specification

98%

References

  • (1) Huppatz, John L.; Australian Journal of Chemistry 1983, V36(1), P135-47 CAPLUS
  • (2) Holzer, Wolfgang; Journal of Heterocyclic Chemistry 1993, V30(4), P865-72 CAPLUS
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