4-Ethyl-5-Isothiocyanato-1,3-Benzothiazole
[CAS# 208458-52-0]

Identification

• Name: 4-Ethyl-5-Isothiocyanato-1,3-Benzothiazole
• Synonyms: 4-ethyl-5-isothiocyanatobenzo[d]thiazole
• Molecular Formula: C₁₀H₈N₂S₂
• Molecular Weight: 220.31
• CAS Registry Number: 208458-52-0
• SMILES: CCc1c(ccc2c1ncs2)N=C=S
• InChI: 1S/C10H8N2S2/c1-2-7-8(11-5-13)3-4-9-10(7)12-6-14-9/h3-4,6H,2H2,1H3
• InChIKey: NSLZLJPOUSOIFT-UHFFFAOYSA-N

Properties

• Density: 1.309g/cm³ (Cal.)
• Boiling point: 379.003°C at 760 mmHg (Cal.)
• Flash point: 183.015°C (Cal.)
• Refractive index: 1.694 (Cal.)