5-[1-(4-Ethylphenoxy)ethyl]-4-methyl-4H-1,2,4-triazole-3-thiol
[CAS# 669708-93-4]

Identification

• Name: 5-[1-(4-Ethylphenoxy)ethyl]-4-methyl-4H-1,2,4-triazole-3-thiol
• Synonyms: 5-[(4-ethylphenoxy)ethyl]-4-methyl-1,2,4-triazole-3-thiol; 5-[1-(4-ethylphenoxy)ethyl]-4-methyl-4H-1,2,4-triazol-3-yl hydrosulfide; 5-[1-(4-Ethylphenoxy)ethyl]-4-methyl-4H-1,2,4-triazole-3-thiol
• Molecular Formula: C₁₃H₁₇N₃OS
• Molecular Weight: 263.36
• CAS Registry Number: 669708-93-4
• SMILES: CCC1=CC=C(C=C1)OC(C)C2=NN=C(N2C)S
• InChI: 1S/C13H17N3OS/c1-4-10-5-7-11(8-6-10)17-9(2)12-14-15-13(18)16(12)3/h5-9H,4H2,1-3H3,(H,15,18)
• InChIKey: XDNIAMZOUKRHDH-UHFFFAOYSA-N

Properties

• Density: 1.2±0.1g/cm³ (Cal.)
• Boiling point: 438.9±47.0°C at 760 mmHg (Cal.)
• Flash point: 219.2±29.3°C (Cal.)
• Refractive index: 1.611 (Cal.)

Safety Data

• Safety Description: IRRITANT