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· · COA & SDS Disponible para cada producto · Same-day shipping on in-stock items 4-Chloro-2-(methylthio)-6-(pyrrolidin-1-yl)pyrimidine - ≥98% , CAS No.339017-59-3
Synonyms
4-chloro-2-methylsulfanyl-6-pyrrolidin-1-ylpyrimidine | 4-Chloro-2-(methylthio)-6-(pyrrolidin-1-yl)pyrimidine | 4-chloro-2-(methylsulfanyl)-6-(pyrrolidin-1-yl)pyrimidine | AKOS015851148 | MFCD00973753 | 4-chloro-2-(methylsulfanyl)-6-(1-pyrrolidinyl)pyrimi
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Why this grade ≥98% 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
4-chloro-2-methylsulfanyl-6-pyrrolidin-1-ylpyrimidine | 4-Chloro-2-(methylthio)-6-(pyrrolidin-1-yl)pyrimidine | 4-chloro-2-(methylsulfanyl)-6-(pyrrolidin-1-yl)pyrimidine | AKOS015851148 | MFCD00973753 | 4-chloro-2-(methylsulfanyl)-6-(1-pyrrolidinyl)pyrimi
Especificaciones y pureza
≥98%
Condiciones de almacenamiento de almacenamiento
Room temperature
Nombres e identificadores Sonrisas canónicas CSC1=NC(=CC(=N1)Cl)N2CCCC2 IUPAC Name 4-chloro-2-methylsulfanyl-6-pyrrolidin-1-ylpyrimidine InChIKey VVDFPCMQZZEGAD-UHFFFAOYSA-N INCHI 1S/C9H12ClN3S/c1-14-9-11-7(10)6-8(12-9)13-4-2-3-5-13/h6H,2-5H2,1H3 Isómeros SMILES CSC1=NC(=CC(=N1)Cl)N2CCCC2 PubChem CID 1484517 Peso molecular 229.7
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 Organosulfur compounds Clase Thioethers Subclass Aryl thioethers Intermediate Tree Nodes Not available Direct Parent Aryl thioethers Alternative Parents Dialkylarylamines Halopyrimidines Aminopyrimidines and derivatives Alkylarylthioethers Imidolactams Aryl chlorides Pyrrolidines Heteroaromatic compounds Sulfenyl compounds Azacyclic compounds Organopnictogen compounds Organochlorides Hydrocarbon derivatives Molecular Framework Aromatic heteromonocyclic compounds Substituents Aryl thioether - Dialkylarylamine - Aminopyrimidine - Halopyrimidine - Alkylarylthioether - Aryl chloride - Aryl halide - Pyrimidine - Imidolactam - Heteroaromatic compound - Pyrrolidine - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Organochloride - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organopnictogen compound - Aromatic heteromonocyclic compound Descripción This compound belongs to the class of organic compounds known as aryl thioethers. These are organosulfur compounds containing a thioether group that is substituted by an aryl group. 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 Certificados (CoA, COO, BSE/TSE y tabla de análisis) Propiedades químicas y físicas Peso molecular 229.730 g/mol XLogP3 3.000 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 4 Rotatable Bond Count 2 Exact Mass 229.044 Da Monoisotopic Mass 229.044 Da Topological Polar Surface Area 54.300 Ų Heavy Atom Count 14 Formal Charge 0 Complexity 187.000 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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