5-Methyl-7-Nitro-1,3-Benzothiazol-2(3H)-One
[CAS# 131908-96-8]

Identification

• Name: 5-Methyl-7-Nitro-1,3-Benzothiazol-2(3H)-One
• Synonyms: 5-methyl-7-nitrobenzo[d]thiazol-2(3H)-one
• Molecular Formula: C₈H₆N₂O₃S
• Molecular Weight: 210.21
• CAS Registry Number: 131908-96-8
• SMILES: [O-][N+](=O)c1cc(C)cc2NC(=O)Sc12
• InChI: 1S/C8H6N2O3S/c1-4-2-5-7(14-8(11)9-5)6(3-4)10(12)13/h2-3H,1H3,(H,9,11)
• InChIKey: ZGYIOMXBAHBJHU-UHFFFAOYSA-N

Properties

• Density: 1.516g/cm³ (Cal.)
• Refractive index: 1.676 (Cal.)