4-Bromo-2-(4-Methyl-5-Sulfanyl-4H-1,2,4-Triazol-3-Yl)Phenol
[CAS# 406184-39-2]

Identification

• Name: 4-Bromo-2-(4-Methyl-5-Sulfanyl-4H-1,2,4-Triazol-3-Yl)Phenol
• Synonyms: 5-(5-bromo-2-hydroxyphenyl)-4-methyl-2,4-dihydro-3H-1,2,4-triazole-3-thione; MFCD20503016
• Molecular Formula: C₉H₈BrN₃OS
• Molecular Weight: 286.15
• CAS Registry Number: 406184-39-2
• SMILES: CN1C(=NN=C1S)C2=C(C=CC(=C2)Br)O
• InChI: 1S/C9H8BrN3OS/c1-13-8(11-12-9(13)15)6-4-5(10)2-3-7(6)14/h2-4,14H,1H3,(H,12,15)
• InChIKey: SLYDYXWQQJZQFZ-UHFFFAOYSA-N

Properties

• Density: 1.8±0.1g/cm³ (Cal.)
• Boiling point: 459.8±55.0°C at 760 mmHg (Cal.)
• Flash point: 231.9±31.5°C (Cal.)
• Refractive index: 1.75 (Cal.)