5-Ethyl-4-[(E)-Pentylideneamino]-2,4-Dihydro-3H-1,2,4-Triazole-3-Thione
[CAS# 452276-49-2]

Identification

• Name: 5-Ethyl-4-[(E)-Pentylideneamino]-2,4-Dihydro-3H-1,2,4-Triazole-3-Thione
• Synonyms: (E)-3-ethyl-4-(pentylideneamino)-1H-1,2,4-triazole-5(4H)-thione
• Molecular Formula: C₉H₁₆N₄S
• Molecular Weight: 212.32
• CAS Registry Number: 452276-49-2
• SMILES: CCCC/C=N/N1C(=NNC1=S)CC
• InChI: 1S/C9H16N4S/c1-3-5-6-7-10-13-8(4-2)11-12-9(13)14/h7H,3-6H2,1-2H3,(H,12,14)/b10-7+
• InChIKey: IOIDSMSHDMMPCW-JXMROGBWSA-N

Properties

• Density: 1.2±0.1g/cm³ (Cal.)
• Boiling point: 282.9±23.0°C at 760 mmHg (Cal.)
• Flash point: 124.9±22.6°C (Cal.)
• Refractive index: 1.596 (Cal.)