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· · COA & SDS Disponible para cada producto · Same-day shipping on in-stock items 2-Ethynylbenzothiazole - ≥97% , CAS No.40176-80-5
Synonyms
EN300-107722 | MFCD08703599 | 2-ethynylbenzo[d]thiazole | D90592 | DTXSID20348794 | 2-ethynyl-benzo[d]thiazole | F2167-5012 | benzothiazole, 2-ethynyl- | AKOS006238562 | E1091 | 2-ethynylbenzothiazole | 2-ethynyl-1,3-benzothiazole | InChI=1/C9H5NS/c1-2-9-
Storage
Store at -20°C,Argon charged
Shipped In
Ice chest + Ice pads
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Why this grade ≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Store at -20°C,Argon charged Ships Ice chest + Ice pads 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.
Specifications Sinónimos
EN300-107722 | MFCD08703599 | 2-ethynylbenzo[d]thiazole | D90592 | DTXSID20348794 | 2-ethynyl-benzo[d]thiazole | F2167-5012 | benzothiazole, 2-ethynyl- | AKOS006238562 | E1091 | 2-ethynylbenzothiazole | 2-ethynyl-1, 3-benzothiazole | InChI=1/C9H5NS/c1-2-9-
Especificaciones y pureza
≥97%
Condiciones de almacenamiento de almacenamiento
Store at -20°C, Argon charged
Enviado en
Ice chest + Ice pads
Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.
Nombres e identificadores Pubchem Sid 504759690 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/504759690 Sonrisas canónicas C#CC1=NC2=CC=CC=C2S1 IUPAC Name 2-ethynyl-1,3-benzothiazole InChIKey ZLVCPVCGNOKHRF-UHFFFAOYSA-N INCHI 1S/C9H5NS/c1-2-9-10-7-5-3-4-6-8(7)11-9/h1,3-6H Isómeros SMILES C#CC1=NC2=CC=CC=C2S1 Peso molecular 159.21 Reaxy-Rn 1210241 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1210241&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 Clase Benzothiazoles Subclass Not available Intermediate Tree Nodes Not available Direct Parent Benzothiazoles Alternative Parents Benzenoids Thiazoles Heteroaromatic compounds Azacyclic compounds Acetylides Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives Molecular Framework Aromatic heteropolycyclic compounds Substituents 1,3-benzothiazole - Benzenoid - Heteroaromatic compound - Thiazole - Azole - Acetylide - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteropolycyclic compound Descripción 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.
Estructura 3D Objetivos asociados (humanos) Mecanismos de acción Certificados (CoA, COO, BSE/TSE y tabla de análisis) Propiedades químicas y físicas Sensibilidad Air Sensitive,Heat Sensitive Punto de fusión (°C) 41 °C Peso molecular 159.210 g/mol XLogP3 2.900 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 2 Rotatable Bond Count 1 Exact Mass 159.014 Da Monoisotopic Mass 159.014 Da Topological Polar Surface Area 41.100 Ų Heavy Atom Count 11 Formal Charge 0 Complexity 193.000 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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