3-Cyano-5-Methyl-1H-Pyrazole-4-Carboxylic Acid
[CAS# 191419-06-4]

Identification

• Name: 3-Cyano-5-Methyl-1H-Pyrazole-4-Carboxylic Acid
• Synonyms: 1H-PYRAZOLE-4-CARBOXYLICACID, 3-CYANO-5-METHYL-; 3-cyano-5-methyl-1H-pyrazole-4-carboxylic acid
• Molecular Formula: C₆H₅N₃O₂
• Molecular Weight: 151.12
• CAS Registry Number: 191419-06-4
• SMILES: O=C(O)c1c(C#N)nnc1C
• InChI: 1S/C6H5N3O2/c1-3-5(6(10)11)4(2-7)9-8-3/h1H3,(H,8,9)(H,10,11)
• InChIKey: QXSSOPPFRJECIH-UHFFFAOYSA-N

Properties

• Density: 1.519g/cm³ (Cal.)
• Boiling point: 494.134°C at 760 mmHg (Cal.)
• Flash point: 252.643°C (Cal.)
• Refractive index: 1.598 (Cal.)