3-Oxo-1,2-Benzisothiazole-2(3H)-propanoic acid 1,1-dioxide
[CAS# 83747-21-1]

Identification

• Name: 3-Oxo-1,2-Benzisothiazole-2(3H)-propanoic acid 1,1-dioxide
• Molecular Formula: C₁₀H₈NO₅S
• Molecular Weight: 254.24
• CAS Registry Number: 83747-21-1
• SMILES: C1=CC=CC2=C1[S](=O)(=O)N(C2=O)CCC([O-])=O
• InChI: 1S/C10H9NO5S/c12-9(13)5-6-11-10(14)7-3-1-2-4-8(7)17(11,15)16/h1-4H,5-6H2,(H,12,13)/p-1
• InChIKey: GZWYJHUJOLOMKY-UHFFFAOYSA-M

Properties

• Boiling point: 518.163°C at 760 mmHg (Cal.)
• Flash point: 267.176°C (Cal.)