4-Methoxy-5-Nitro-1,3-Benzothiazole
[CAS# 208458-61-1]

Identification

• Name: 4-Methoxy-5-Nitro-1,3-Benzothiazole
• Synonyms: 4-methoxy-5-nitrobenzo[d]thiazole
• Molecular Formula: C₈H₆N₂O₃S
• Molecular Weight: 210.21
• CAS Registry Number: 208458-61-1
• SMILES: COc1c(ccc2c1ncs2)[N+](=O)[O-]
• InChI: 1S/C8H6N2O3S/c1-13-8-5(10(11)12)2-3-6-7(8)9-4-14-6/h2-4H,1H3
• InChIKey: NYDMHDUPENGRTO-UHFFFAOYSA-N

Properties

• Density: 1.479g/cm³ (Cal.)
• Boiling point: 381.787°C at 760 mmHg (Cal.)
• Flash point: 184.699°C (Cal.)
• Refractive index: 1.682 (Cal.)