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· · COA & SDS available for every product · Same-day shipping on in-stock items 3-Chloro-4-(trifluoromethylthio)aniline - Reagent grade , CAS No.64628-74-6
GRADE & PURITY Reagent Grade ? General reagent-grade purity suitable for most laboratory work. Use as a dependable default when no specific higher grade is required. Synonyms
3-chloro-4-trifluoromethylsulfanyl-phenylamine | D73301 | AS-65230 | EN300-746414 | 3-Chloro-4-((trifluoromethyl)thio)aniline | 3-Chloro-4-(trifluoromethylthio)aniline, 97% | Benzenamine,3-chloro-4-[(trifluoromethyl)thio]- | SCHEMBL1403756 | 3-chloranyl-4
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Why this grade Reagent grade Reagent Grade for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Room temperature Ships 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
3-chloro-4-trifluoromethylsulfanyl-phenylamine | D73301 | AS-65230 | EN300-746414 | 3-Chloro-4-((trifluoromethyl)thio)aniline | 3-Chloro-4-(trifluoromethylthio)aniline, 97% | Benzenamine, 3-chloro-4-[(trifluoromethyl)thio]- | SCHEMBL1403756 | 3-chloranyl-4
Specifications & Purity
Reagent grade
Names and Identifiers Canonical Smiles C1=CC(=C(C=C1N)Cl)SC(F)(F)F IUPAC Name 3-chloro-4-(trifluoromethylsulfanyl)aniline InChIKey BLOPJEJSRKMVSU-UHFFFAOYSA-N INCHI 1S/C7H5ClF3NS/c8-5-3-4(12)1-2-6(5)13-7(9,10)11/h1-3H,12H2 Isomeric SMILES C1=CC(=C(C=C1N)Cl)SC(F)(F)F Molecular Weight 227.63 Reaxy-Rn 6314200 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=6314200&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 Organosulfur compounds Class Thioethers Subclass Aryl thioethers Intermediate Tree Nodes Not available Direct Parent Aryl thioethers Alternative Parents Thiophenol ethers Aniline and substituted anilines Chlorobenzenes Alkylarylthioethers Aryl chlorides Trihalomethanes Sulfenyl compounds Primary amines Organopnictogen compounds Organofluorides Organochlorides Hydrocarbon derivatives Alkyl fluorides Molecular Framework Aromatic homomonocyclic compounds Substituents Aryl thioether - Thiophenol ether - Aniline or substituted anilines - Chlorobenzene - Halobenzene - Alkylarylthioether - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Trihalomethane - Sulfenyl compound - Primary amine - Organonitrogen compound - Organofluoride - Organochloride - Organohalogen compound - Organopnictogen compound - Organic nitrogen compound - Amine - Alkyl halide - Alkyl fluoride - Halomethane - Hydrocarbon derivative - Aromatic homomonocyclic 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 Melt Point(°C) 41-43 Molecular Weight 227.640 g/mol XLogP3 3.600 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 5 Rotatable Bond Count 1 Exact Mass 226.978 Da Monoisotopic Mass 226.978 Da Topological Polar Surface Area 51.300 Ų Heavy Atom Count 13 Formal Charge 0 Complexity 176.000 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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