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· · COA & SDS available for every product · Same-day shipping on in-stock items Benzothiazole-6-carboxylic acid - ≥96% , CAS No.3622-35-3
Synonyms
AC-2614 | AKOS000813891 | Benzothiazole-6-carboxylic acid, 96% | 6-Benzothiazolecarboxylic acid | benzothiazole-6-carboxylic | Benzothiazole-6-carboxylic acid | AB03450 | benzo[d]thiazole-6-carboxylicacid | MLS001003038 | Z56899168 | STK716497 | cid_60167
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Why this grade ≥96% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Room temperature Ships Normal Check lot-specific COA for exact specifications.
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Quality documents SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
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Literature proof Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Overview Benzothiazole-6-carboxylic acid (BTCA) is a benzothiazole derivative.
Specifications Synonyms
AC-2614 | AKOS000813891 | Benzothiazole-6-carboxylic acid, 96% | 6-Benzothiazolecarboxylic acid | benzothiazole-6-carboxylic | Benzothiazole-6-carboxylic acid | AB03450 | benzo[d]thiazole-6-carboxylicacid | MLS001003038 | Z56899168 | STK716497 | cid_60167
Specifications & Purity
≥96%
Names and Identifiers Pubchem Sid 488190629 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/488190629 Canonical Smiles C1=CC2=C(C=C1C(=O)O)SC=N2 IUPAC Name 1,3-benzothiazole-6-carboxylic acid InChIKey DMPZJACLHDWUFS-UHFFFAOYSA-N INCHI 1S/C8H5NO2S/c10-8(11)5-1-2-6-7(3-5)12-4-9-6/h1-4H,(H,10,11) Isomeric SMILES C1=CC2=C(C=C1C(=O)O)SC=N2 WGK Germany 3 Molecular Weight 179.2 Reaxy-Rn 132112 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=132112&ln=
Documentation 📋 Safety Data Sheet (SDS) Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS → ✅ Certificate of Analysis (COA) Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA → 📊 Datasheet Quick-reference summary of product specifications and applications.
View datasheet → 🔬 Specification Sheet Full quality attributes and acceptance criteria for this grade.
View spec sheet →
Advanced Data Taxonomic Classification Kingdom Organic compounds Superclass Organoheterocyclic compounds Class Benzothiazoles Subclass Not available Intermediate Tree Nodes Not available Direct Parent Benzothiazoles Alternative Parents Benzenoids Thiazoles Heteroaromatic compounds Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Molecular Framework Aromatic heteropolycyclic compounds Substituents 1,3-benzothiazole - Benzenoid - Azole - Thiazole - Heteroaromatic compound - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Azacycle - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Aromatic heteropolycyclic compound Description This compound belongs to the class of organic compounds known as benzothiazoles. These are organic compounds containing a benzene fused to a thiazole ring (a five-membered ring with four carbon atoms, one nitrogen atom and one sulfur atom). External Descriptors Not available Data sources 1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
3D Structure Associated Targets(Human) Associated Targets(non-human) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Molecular Weight 179.200 g/mol XLogP3 1.500 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 4 Rotatable Bond Count 1 Exact Mass 179.004 Da Monoisotopic Mass 179.004 Da Topological Polar Surface Area 78.400 Ų Heavy Atom Count 12 Formal Charge 0 Complexity 197.000 Isotope Atom Count 0 Defined Atom Stereocenter Count 0 Undefined Atom Stereocenter Count 0 Defined Bond Stereocenter Count 0 Undefined Bond Stereocenter Count 0 The total count of all stereochemical bonds 0 Covalently-Bonded Unit Count 1
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