4-Allyl-5-[1-(4-methoxyphenoxy)ethyl]-4H-1,2,4-triazole-3-thiol
[CAS# 669737-43-3]

Identification

• Name: 4-Allyl-5-[1-(4-methoxyphenoxy)ethyl]-4H-1,2,4-triazole-3-thiol
• Synonyms: 5-[(4-methoxyphenoxy)ethyl]-4-prop-2-enyl-1,2,4-triazole-3-thiol; 5-[1-(4-methoxyphenoxy)ethyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazole-3-thiol; MFCD04054748
• Molecular Formula: C₁₄H₁₇N₃O₂S
• Molecular Weight: 291.37
• CAS Registry Number: 669737-43-3
• SMILES: CC(C1=NN=C(N1CC=C)S)OC2=CC=C(C=C2)OC
• InChI: 1S/C14H17N3O2S/c1-4-9-17-13(15-16-14(17)20)10(2)19-12-7-5-11(18-3)6-8-12/h4-8,10H,1,9H2,2-3H3,(H,16,20)
• InChIKey: IVMYIAUJRKKCNH-UHFFFAOYSA-N

Properties

• Density: 1.2±0.1g/cm³ (Cal.)
• Boiling point: 472.7±55.0°C at 760 mmHg (Cal.)
• Flash point: 239.7±31.5°C (Cal.)
• Refractive index: 1.594 (Cal.)

Safety Data

• Safety Description: IRRITANT