5-[(4-Chlorophenoxy)Methyl]-4-Methyl-4H-1,2,4-Triazole-3-Thiol
[CAS# 424798-45-8]

Identification

• Name: 5-[(4-Chlorophenoxy)Methyl]-4-Methyl-4H-1,2,4-Triazole-3-Thiol
• Synonyms: 4H-1,2,4-triazole-3-thiol; 5-(4-Chloro-phenoxymethyl)-4-methyl-4H-[1,2,4]triazole-3-thiol; 5-[(4-Chlorophenoxy)methyl]-4-methyl-
• Molecular Formula: C₁₀H₁₀ClN₃OS
• Molecular Weight: 255.72
• CAS Registry Number: 424798-45-8
• SMILES: CN1C(=NN=C1S)COC2=CC=C(C=C2)Cl
• InChI: 1S/C10H10ClN3OS/c1-14-9(12-13-10(14)16)6-15-8-4-2-7(11)3-5-8/h2-5H,6H2,1H3,(H,13,16)
• InChIKey: SHNVNBCQCBLEDN-UHFFFAOYSA-N

Properties

• Density: 1.4±0.1g/cm³ (Cal.)
• Boiling point: 444.7±51.0°C at 760 mmHg (Cal.)
• Flash point: 222.7±30.4°C (Cal.)
• Refractive index: 1.661 (Cal.)

Safety Data

• Safety Description: IRRITANT