Benzothiazole-6-carboxylic acid structure

Benzothiazole-6-carboxylic acid

1,3-benzothiazole-6-carboxylic acid

Also Known As: Benzothiazole-6-carboxylic acid|1,3-Benzothiazole-6-carboxylic acid|6-Benzothiazolecarboxylic acid|benzo[d]thiazole-6-carboxylic acid|xianglian pill|zlchem 73|Enamine_005417|benzothiazole-6-carboxylic|6-Benzothiazolecarboxylicacid|trans-1,2-Dichlorocyclohexane|Jsp006465|CL-COB-III-274-2|benzo[d]thiazole-6-carboxylicacid|ZLB0060|Benzo[d]thiazole-6-carboxylic?acid|Fr12380|BENZOTHIAZOLE-6-CARBOXYLICACID

CAS: 3622-35-3
Molecular Formula C8H5NO2S
Molecular Weight 179.0041 g/mol
LogP 1.5
Topological Polar Surface Area 78.4 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 4
Rotatable Bonds 1
Exact Mass 179.0041
Monoisotopic Mass 179.0041
Heavy Atoms 12
Complexity 197.0

Chemical Identifiers

CAS Number 3622-35-3
SMILES C1=CC2=C(C=C1C(=O)O)SC=N2
InChIKey DMPZJACLHDWUFS-UHFFFAOYSA-N

Patent-Derived Application Labels

Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.

Agrochemicals (40 patents) Analytical Reagents (13 patents) Biotechnology (28 patents) Dyes & Pigments (2 patents) Heterocyclic Building Blocks (422 patents) Organic Building Blocks (45 patents) Organometallic Reagents (5 patents) Peptides & Amino Acids (18 patents) Pharmaceutical Intermediates (375 patents) Photographic Chemicals (6 patents) Polymer Intermediates (3 patents) Specialty Chemicals (1 patents)

Product Overview

Benzothiazole-6-carboxylic acid (CAS 3622-35-3), with molecular formula C8H5NO2S and molecular weight 179.0041 g/mol. IUPAC: 1,3-benzothiazole-6-carboxylic acid.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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