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· · COA & SDS available for every product · Same-day shipping on in-stock items 4-chloro-5-iodo-2-methylsulfanyl-pyrimidine - ≥97% , CAS No.111079-19-7
Synonyms
AKOS025402827 | 4-Chloro-5-iodo-2-(methylthio)pyrimidine | SCHEMBL1493979 | DTXSID70545574 | 4-chloro-5-iodo-2-methylthiopyrimidine | 4-chloro-5-iodo-2-methylsulfanylpyrimidine | 4-chloro-5-iodo-2-methylsulfanyl-pyrimidine | RPTQHLHIBGHGBF-UHFFFAOYSA-N |
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Why this grade ≥97% 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 Synonyms
AKOS025402827 | 4-Chloro-5-iodo-2-(methylthio)pyrimidine | SCHEMBL1493979 | DTXSID70545574 | 4-chloro-5-iodo-2-methylthiopyrimidine | 4-chloro-5-iodo-2-methylsulfanylpyrimidine | 4-chloro-5-iodo-2-methylsulfanyl-pyrimidine | RPTQHLHIBGHGBF-UHFFFAOYSA-N |
Specifications & Purity
≥97%
Names and Identifiers Canonical Smiles CSC1=NC=C(C(=N1)Cl)I IUPAC Name 4-chloro-5-iodo-2-methylsulfanylpyrimidine InChIKey RPTQHLHIBGHGBF-UHFFFAOYSA-N INCHI 1S/C5H4ClIN2S/c1-10-5-8-2-3(7)4(6)9-5/h2H,1H3 Isomeric SMILES CSC1=NC=C(C(=N1)Cl)I Alternate CAS 111079-19-7 PubChem CID 13636519 Molecular Weight 286.52
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 Class Thioethers Subclass Aryl thioethers Intermediate Tree Nodes Not available Direct Parent Aryl thioethers Alternative Parents Halopyrimidines Alkylarylthioethers Aryl iodides Aryl chlorides Heteroaromatic compounds Sulfenyl compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organoiodides Organochlorides Hydrocarbon derivatives Molecular Framework Aromatic heteromonocyclic compounds Substituents Aryl thioether - Halopyrimidine - Alkylarylthioether - Aryl chloride - Aryl halide - Aryl iodide - Pyrimidine - Heteroaromatic compound - Sulfenyl compound - Organoheterocyclic compound - Azacycle - Organopnictogen compound - Organonitrogen compound - Organoiodide - Organochloride - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Aromatic heteromonocyclic compound Description 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.
3D Structure Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Molecular Weight 286.520 g/mol XLogP3 2.700 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 3 Rotatable Bond Count 1 Exact Mass 285.883 Da Monoisotopic Mass 285.883 Da Topological Polar Surface Area 51.100 Ų Heavy Atom Count 10 Formal Charge 0 Complexity 116.000 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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