2-Benzyl-4-Ethyl-2,4-Dihydro-3H-1,2,4-Triazole-3-Thione
[CAS# 535961-52-5]

Identification

• Name: 2-Benzyl-4-Ethyl-2,4-Dihydro-3H-1,2,4-Triazole-3-Thione
• Synonyms: 1-benzyl-4-ethyl-1H-1,2,4-triazole-5(4H)-thione
• Molecular Formula: C₁₁H₁₃N₃S
• Molecular Weight: 219.31
• CAS Registry Number: 535961-52-5
• SMILES: CCn1cnn(c1=S)Cc2ccccc2
• InChI: 1S/C11H13N3S/c1-2-13-9-12-14(11(13)15)8-10-6-4-3-5-7-10/h3-7,9H,2,8H2,1H3
• InChIKey: CUYQXNMTIGDUCP-UHFFFAOYSA-N

Properties

• Density: 1.174g/cm³ (Cal.)
• Boiling point: 312.382°C at 760 mmHg (Cal.)
• Flash point: 142.724°C (Cal.)
• Refractive index: 1.628 (Cal.)