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· · COA & SDS Disponible para cada producto · Same-day shipping on in-stock items N-Methylsaccharin - ≥98%(GC) , CAS No.15448-99-4
Synonyms
2-methyl-1,1-dioxo-1,2-benzothiazol-3-one | 2-methyl-1,1-dioxo-benzo[d]isothiazol-3-one | EINECS 239-466-7 | SY053783 | DTXSID10165639 | 2-Methyl-1,1-dioxide | SCHEMBL107126 | NSC 39120 | Q27289719 | D78426 | AI3-23674 | M0427 | 2-methyl-2,3-dihydro-1,2-b
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Why this grade ≥98%(GC) 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.
Specifications Sinónimos
2-methyl-1, 1-dioxo-1, 2-benzothiazol-3-one | 2-methyl-1, 1-dioxo-benzo[d]isothiazol-3-one | EINECS 239-466-7 | SY053783 | DTXSID10165639 | 2-Methyl-1, 1-dioxide | SCHEMBL107126 | NSC 39120 | Q27289719 | D78426 | AI3-23674 | M0427 | 2-methyl-2, 3-dihydro-1, 2-b
Especificaciones y pureza
≥98%(GC)
Condiciones de almacenamiento de almacenamiento
Room temperature
Nombres e identificadores Pubchem Sid 504753354 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/504753354 Sonrisas canónicas CN1C(=O)C2=CC=CC=C2S1(=O)=O IUPAC Name 2-methyl-1,1-dioxo-1,2-benzothiazol-3-one InChIKey DDIIAJRLFATEEE-UHFFFAOYSA-N INCHI 1S/C8H7NO3S/c1-9-8(10)6-4-2-3-5-7(6)13(9,11)12/h2-5H,1H3 Isómeros SMILES CN1C(=O)C2=CC=CC=C2S1(=O)=O Peso molecular 197.21 Beilstein 27(1)218 Reaxy-Rn 162901 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=162901&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 Organosulfonic acids and derivatives Carboxylic acids and derivatives Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Molecular Framework Aromatic heteropolycyclic compounds Substituents 1,2-benzothiazole - Benzenoid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Azacycle - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - 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 Punto de fusión (°C) 131 °C Peso molecular 197.210 g/mol XLogP3 0.600 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 3 Rotatable Bond Count 0 Exact Mass 197.015 Da Monoisotopic Mass 197.015 Da Topological Polar Surface Area 62.800 Ų Heavy Atom Count 13 Formal Charge 0 Complexity 330.000 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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