7-Nitro-1,3-Benzothiazole-2-Carbonitrile
[CAS# 188672-86-8]

Identification

• Name: 7-Nitro-1,3-Benzothiazole-2-Carbonitrile
• Synonyms: 7-nitrobenzo[d]thiazole-2-carbonitrile
• Molecular Formula: C₈H₃N₃O₂S
• Molecular Weight: 205.19
• CAS Registry Number: 188672-86-8
• SMILES: c1cc2c(c(c1)[N+](=O)[O-])sc(n2)C#N
• InChI: 1S/C8H3N3O2S/c9-4-7-10-5-2-1-3-6(11(12)13)8(5)14-7/h1-3H
• InChIKey: LUBJQUHZCQPBJC-UHFFFAOYSA-N

Properties

• Density: 1.588g/cm³ (Cal.)
• Boiling point: 393.761°C at 760 mmHg (Cal.)
• Flash point: 191.94°C (Cal.)
• Refractive index: 1.717 (Cal.)