2-Isocyanato-5-methyl-1,3-benzothiazole
[CAS# 63876-63-1]

Identification

• Name: 2-Isocyanato-5-methyl-1,3-benzothiazole
• Synonyms: 2-isocyanato-5-methylbenzo[d]thiazole
• Molecular Formula: C₉H₆N₂OS
• Molecular Weight: 190.22
• CAS Registry Number: 63876-63-1
• SMILES: Cc1ccc2c(c1)nc(s2)N=C=O
• InChI: 1S/C9H6N2OS/c1-6-2-3-8-7(4-6)11-9(13-8)10-5-12/h2-4H,1H3
• InChIKey: PPVFCNCAOMPPMI-UHFFFAOYSA-N

Properties

• Density: 1.352g/cm³ (Cal.)
• Boiling point: 321.434°C at 760 mmHg (Cal.)
• Flash point: 148.198°C (Cal.)