4,5-Dihydro-5-Oxo-3-Phenyl-1H-Pyrazole-1-Carbothioamide
[CAS# 58197-04-9]

Identification

• Name: 4,5-Dihydro-5-Oxo-3-Phenyl-1H-Pyrazole-1-Carbothioamide
• Synonyms: 5-Keto-3-Phenyl-4H-Pyrazole-1-Carbothioamide; 1H-Pyrazole-1-Carbothioamide, 4,5-Dihydro-5-Oxo-3-Phenyl-; Nsc119927
• Molecular Formula: C₁₀H₉N₃OS
• Molecular Weight: 219.26
• CAS Registry Number: 58197-04-9
• SMILES: C1=CC=CC=C1C2=NN(C(N)=S)C(C2)=O
• InChI: 1S/C10H9N3OS/c11-10(15)13-9(14)6-8(12-13)7-4-2-1-3-5-7/h1-5H,6H2,(H2,11,15)
• InChIKey: LQRTZZUNSKIADN-UHFFFAOYSA-N

Properties

• Density: 1.416g/cm³ (Cal.)
• Boiling point: 366.36°C at 760 mmHg (Cal.)
• Flash point: 175.369°C (Cal.)