5-Nitro-1,3-Benzothiazol-2(3H)-One
[CAS# 62386-22-5]

Identification

• Name: 5-Nitro-1,3-Benzothiazol-2(3H)-One
• Synonyms: 2(3H)-Benzothiazolone, 5-nitro-; 2(3H)-Benzothiazolone,5-nitro-; 5-Nitro-1,3-benzothiazol-2-ol #
• Molecular Formula: C₇H₄N₂O₃S
• Molecular Weight: 196.18
• CAS Registry Number: 62386-22-5
• SMILES: [O-][N+](=O)c2cc1c(SC(=O)N1)cc2
• InChI: 1S/C7H4N2O3S/c10-7-8-5-3-4(9(11)12)1-2-6(5)13-7/h1-3H,(H,8,10)
• InChIKey: GLRHCXKQSXFQHY-UHFFFAOYSA-N

Properties

• Density: 1.603g/cm³ (Cal.)