2,5-Dimethyl-3-thioxo-2,3-dihydro-1H-pyrazole-4-carbonitrile
[CAS# 754930-66-0]

Identification

• Name: 2,5-Dimethyl-3-thioxo-2,3-dihydro-1H-pyrazole-4-carbonitrile
• Synonyms: 2,5-dimethyl-3-thioxo-2,3-dihydro-1H-pyrazole-4-carbonitrile
• Molecular Formula: C₆H₇N₃S
• Molecular Weight: 153.20
• CAS Registry Number: 754930-66-0
• SMILES: Cc1c(c(=S)n([nH]1)C)C#N
• InChI: 1S/C6H7N3S/c1-4-5(3-7)6(10)9(2)8-4/h8H,1-2H3
• InChIKey: PVNHSUMCTCUNAM-UHFFFAOYSA-N

Properties

• Density: 1.322g/cm³ (Cal.)
• Boiling point: 214.618°C at 760 mmHg (Cal.)
• Flash point: 83.598°C (Cal.)
• Refractive index: 1.641 (Cal.)