1,3-Dimethyl-5-sulfanyl-1H-pyrazole-4-carbonitrile
[CAS# 87573-92-0]

Identification

• Name: 1,3-Dimethyl-5-sulfanyl-1H-pyrazole-4-carbonitrile
• Synonyms: 5-mercapto-1,3-dimethyl-1H-pyrazole-4-carbonitrile
• Molecular Formula: C₆H₇N₃S
• Molecular Weight: 153.20
• CAS Registry Number: 87573-92-0
• SMILES: Cc1c(c(n(n1)C)S)C#N
• InChI: 1S/C6H7N3S/c1-4-5(3-7)6(10)9(2)8-4/h10H,1-2H3
• InChIKey: YQTFJKUCEWACLE-UHFFFAOYSA-N

Properties

• Density: 1.28g/cm³ (Cal.)
• Boiling point: 319.986°C at 760 mmHg (Cal.)
• Flash point: 147.323°C (Cal.)