3-Acetamido-4-Cyano-5-Methyl-4,5-Dihydro-3H-Pyrazole-3-Carboxylic Acid
[CAS# 204767-46-4]

Identification

• Name: 3-Acetamido-4-Cyano-5-Methyl-4,5-Dihydro-3H-Pyrazole-3-Carboxylic Acid
• Molecular Formula: C₈H₁₀N₄O₃
• Molecular Weight: 210.19
• CAS Registry Number: 204767-46-4
• SMILES: CC1C(C(N=N1)(C(=O)O)NC(=O)C)C#N
• InChI: 1S/C8H10N4O3/c1-4-6(3-9)8(7(14)15,12-11-4)10-5(2)13/h4,6H,1-2H3,(H,10,13)(H,14,15)
• InChIKey: NEFNCOGPGFKENQ-UHFFFAOYSA-N

Properties

• Density: 1.5±0.1g/cm³ (Cal.)
• Boiling point: 541.3±50.0°C at 760 mmHg (Cal.)
• Flash point: 281.1±30.1°C (Cal.)
• Refractive index: 1.648 (Cal.)