4-Ethyl-5-[(3-Methylphenoxy)Methyl]-4H-1,2,4-Triazole-3-Thiol
[CAS# 307327-55-5]

Identification

• Name: 4-Ethyl-5-[(3-Methylphenoxy)Methyl]-4H-1,2,4-Triazole-3-Thiol
• Synonyms: 4-Ethyl-5-[(3-methylphenoxy)methyl]-4H-1,2,4-triazole-3-thiol; 4-Ethyl-5-m-tolyloxymethyl-4H-[1,2,4]triazole-3-thiol; MFCD01163895
• Molecular Formula: C₁₂H₁₅N₃OS
• Molecular Weight: 249.33
• CAS Registry Number: 307327-55-5
• SMILES: CCN1C(=NN=C1S)COC2=CC=CC(=C2)C
• InChI: 1S/C12H15N3OS/c1-3-15-11(13-14-12(15)17)8-16-10-6-4-5-9(2)7-10/h4-7H,3,8H2,1-2H3,(H,14,17)
• InChIKey: CGPFUNSHKFINOJ-UHFFFAOYSA-N

Properties

• Density: 1.2±0.1g/cm³ (Cal.)
• Boiling point: 439.2±47.0°C at 760 mmHg (Cal.)
• Flash point: 219.4±29.3°C (Cal.)
• Refractive index: 1.62 (Cal.)

Safety Data

• Safety Description: IRRITANT