3-Amino-1,2-benzothiazole-6-carboxylic acid
[CAS# 613262-39-8]

Identification

• Name: 3-Amino-1,2-benzothiazole-6-carboxylic acid
• Synonyms: 3-aminobenzo[d]isothiazole-6-carboxylic acid
• Molecular Formula: C₈H₆N₂O₂S
• Molecular Weight: 194.21
• CAS Registry Number: 613262-39-8
• SMILES: C1=CC2=C(C=C1C(=O)O)SN=C2N
• InChI: 1S/C8H6N2O2S/c9-7-5-2-1-4(8(11)12)3-6(5)13-10-7/h1-3H,(H2,9,10)(H,11,12)
• InChIKey: UPCMCKQRUBJVNE-UHFFFAOYSA-N

Properties

• Density: 1.6±0.1g/cm³ (Cal.)
• Boiling point: 365.4±24.0°C at 760 mmHg (Cal.)
• Flash point: 174.8±22.9°C (Cal.)
• Refractive index: 1.8 (Cal.)