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Home >> Chemical Listing >> Page 1998 >> 3-Amino-1,2-benzothiazole-6-carboxylic acid

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

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Identification
Name 3-Amino-1,2-benzothiazole-6-carboxylic acid
Synonyms 3-aminobenzo[d]isothiazole-6-carboxylic acid
Molecular Structure CAS#: 613262-39-8, 3-Amino-1,2-benzothiazole-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.)
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