1,2-Benzisothiazole-3-Acetic Acid
[CAS# 29266-68-0]

Identification

• Name: 1,2-Benzisothiazole-3-Acetic Acid
• Synonyms: 2-(1,2-Benzothiazol-3-Yl)Ethanoic Acid; 1,2-Benzisothiazol-3-Yl-Acetic Acid; 1,2-Benzisothiazole-3-Acetic Acid
• Molecular Formula: C₉H₇NO₂S
• Molecular Weight: 193.22
• CAS Registry Number: 29266-68-0
• SMILES: C1=CC=CC2=C1SN=C2CC(=O)O
• InChI: 1S/C9H7NO2S/c11-9(12)5-7-6-3-1-2-4-8(6)13-10-7/h1-4H,5H2,(H,11,12)
• InChIKey: HWLOCGLMEHUBAQ-UHFFFAOYSA-N

Properties

• Density: 1.445g/cm³ (Cal.)
• Boiling point: 300.234°C at 760 mmHg (Cal.)
• Flash point: 135.377°C (Cal.)