3-Oxo-3-(3,4,5-Trimethyl-1H-Pyrazol-1-Yl)Propanenitrile
[CAS# 477710-14-8]

Identification

• Name: 3-Oxo-3-(3,4,5-Trimethyl-1H-Pyrazol-1-Yl)Propanenitrile
• Synonyms: 3-oxo-3-(3,4,5-trimethyl-1H-pyrazol-1-yl)propanenitrile
• Molecular Formula: C₉H₁₁N₃O
• Molecular Weight: 177.20
• CAS Registry Number: 477710-14-8
• SMILES: Cc1c(nn(c1C)C(=O)CC#N)C
• InChI: 1S/C9H11N3O/c1-6-7(2)11-12(8(6)3)9(13)4-5-10/h4H2,1-3H3
• InChIKey: LOHXFVZINNDDAB-UHFFFAOYSA-N

Properties

• Density: 1.137g/cm³ (Cal.)
• Boiling point: 356.652°C at 760 mmHg (Cal.)
• Flash point: 169.497°C (Cal.)
• Refractive index: 1.564 (Cal.)