5-(Butylsulfanyl)-4-Ethyl-2,4-Dihydro-3H-1,2,4-Triazol-3-One
[CAS# 340829-40-5]

Identification

• Name: 5-(Butylsulfanyl)-4-Ethyl-2,4-Dihydro-3H-1,2,4-Triazol-3-One
• Synonyms: 3-(butylthio)-4-ethyl-1H-1,2,4-triazol-5(4H)-one
• Molecular Formula: C₈H₁₅N₃OS
• Molecular Weight: 201.29
• CAS Registry Number: 340829-40-5
• SMILES: CCN1C(/SCCCC)=N\NC1=O
• InChI: 1S/C8H15N3OS/c1-3-5-6-13-8-10-9-7(12)11(8)4-2/h3-6H2,1-2H3,(H,9,12)
• InChIKey: SHKSQIOXYUKFAB-UHFFFAOYSA-N

Properties

• Density: 1.234g/cm³ (Cal.)
• Refractive index: 1.592 (Cal.)