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· · COA & SDS available for every product · Same-day shipping on in-stock items 2,4-Difluoro-α-(1H-1,2,4-triazolyl)acetophenone - ≥98%(GC) , CAS No.86404-63-9
Synonyms
1-(2,4-difluoro phenyl)-2-(1H-1,2,4-triazole-1-yl)ethanone | DTXSID70235529 | EC 617-850-9 | O10251 | SR-01000492477 | 1-(2,4-Difluorobenzoylmethyl)-1H-1,2,4-triazole | A19245 | A-(1H-1,2,4-triazolyl)acetophenone | 2,4-Difluoro-?-(1H-1,2,4-triazolyl)aceto
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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 Store at 2-8°C Ships Wet ice 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
1-(2, 4-difluoro phenyl)-2-(1H-1, 2, 4-triazole-1-yl)ethanone | DTXSID70235529 | EC 617-850-9 | O10251 | SR-01000492477 | 1-(2, 4-Difluorobenzoylmethyl)-1H-1, 2, 4-triazole | A19245 | A-(1H-1, 2, 4-triazolyl)acetophenone | 2, 4-Difluoro-?-(1H-1, 2, 4-triazolyl)aceto
Specifications & Purity
≥98%(GC)
Shipped In
Wet ice
This product requires cold chain shipping. Ground and other economy services are not available.
Names and Identifiers Pubchem Sid 504759390 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/504759390 Canonical Smiles C1=CC(=C(C=C1F)F)C(=O)CN2C=NC=N2 IUPAC Name 1-(2,4-difluorophenyl)-2-(1,2,4-triazol-1-yl)ethanone InChIKey XCHRPVARHBCFMJ-UHFFFAOYSA-N INCHI 1S/C10H7F2N3O/c11-7-1-2-8(9(12)3-7)10(16)4-15-6-13-5-14-15/h1-3,5-6H,4H2 Isomeric SMILES C1=CC(=C(C=C1F)F)C(=O)CN2C=NC=N2 WGK Germany 3 Molecular Weight 223.18 Reaxy-Rn 6652789 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=6652789&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 Organic oxygen compounds Class Organooxygen compounds Subclass Carbonyl compounds Intermediate Tree Nodes Ketones - Aryl ketones - Phenylketones Direct Parent Alkyl-phenylketones Alternative Parents Benzoyl derivatives Aryl alkyl ketones Fluorobenzenes Aryl fluorides Vinylogous halides Triazoles Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organofluorides Organic oxides Hydrocarbon derivatives Molecular Framework Aromatic heteromonocyclic compounds Substituents Alkyl-phenylketone - Benzoyl - Aryl alkyl ketone - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Azole - Heteroaromatic compound - 1,2,4-triazole - Vinylogous halide - Azacycle - Organoheterocyclic compound - Organofluoride - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organopnictogen compound - Aromatic heteromonocyclic compound Description This compound belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl 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 Associated Targets(non-human) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Melt Point(°C) 109°C Molecular Weight 223.180 g/mol XLogP3 1.700 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 5 Rotatable Bond Count 3 Exact Mass 223.056 Da Monoisotopic Mass 223.056 Da Topological Polar Surface Area 47.800 Ų Heavy Atom Count 16 Formal Charge 0 Complexity 264.000 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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