4-Allyl-5-[1-(4-ethylphenoxy)ethyl]-4H-1,2,4-triazole-3-thiol
[CAS# 669708-94-5]

Identification

• Name: 4-Allyl-5-[1-(4-ethylphenoxy)ethyl]-4H-1,2,4-triazole-3-thiol
• Synonyms: 5-[(4-ethylphenoxy)ethyl]-4-prop-2-enyl-1,2,4-triazole-3-thiol; 5-[1-(4-ethylphenoxy)ethyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazole-3-thiol; MFCD04057588
• Molecular Formula: C₁₅H₁₉N₃OS
• Molecular Weight: 289.40
• CAS Registry Number: 669708-94-5
• SMILES: CCC1=CC=C(C=C1)OC(C)C2=NN=C(N2CC=C)S
• InChI: 1S/C15H19N3OS/c1-4-10-18-14(16-17-15(18)20)11(3)19-13-8-6-12(5-2)7-9-13/h4,6-9,11H,1,5,10H2,2-3H3,(H,17,20)
• InChIKey: SISVWVRKVKLMOC-UHFFFAOYSA-N

Properties

• Density: 1.2±0.1g/cm³ (Cal.)
• Boiling point: 458.9±55.0°C at 760 mmHg (Cal.)
• Flash point: 231.4±31.5°C (Cal.)
• Refractive index: 1.594 (Cal.)

Safety Data

• Safety Description: IRRITANT