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· · COA & SDS available for every product · Same-day shipping on in-stock items 3-(2-Chloro-phenyl)-7-hydroxy-2-trifluoromethyl-chromen-4-one , CAS No.302953-05-5
Synonyms
3-(2-Chloro-phenyl)-7-hydroxy-2-trifluoromethyl-chromen-4-one | 3-(2-chlorophenyl)-7-hydroxy-2-(trifluoromethyl)-4H-chromen-4-one | 3-(2-chlorophenyl)-7-hydroxy-2-(trifluoromethyl)chromen-4-one | DTXSID901154536 | BDBM50318636 | MFCD01848894 | AKOS0001226
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Why this 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-(2-Chloro-phenyl)-7-hydroxy-2-trifluoromethyl-chromen-4-one | 3-(2-chlorophenyl)-7-hydroxy-2-(trifluoromethyl)-4H-chromen-4-one | 3-(2-chlorophenyl)-7-hydroxy-2-(trifluoromethyl)chromen-4-one | DTXSID901154536 | BDBM50318636 | MFCD01848894 | AKOS0001226
Product Properties Names and Identifiers Canonical Smiles C1=CC=C(C(=C1)C2=C(OC3=C(C2=O)C=CC(=C3)O)C(F)(F)F)Cl IUPAC Name 3-(2-chlorophenyl)-7-hydroxy-2-(trifluoromethyl)chromen-4-one InChIKey NVWFOLBTOQENGO-UHFFFAOYSA-N INCHI 1S/C16H8ClF3O3/c17-11-4-2-1-3-9(11)13-14(22)10-6-5-8(21)7-12(10)23-15(13)16(18,19)20/h1-7,21H Isomeric SMILES C1=CC=C(C(=C1)C2=C(OC3=C(C2=O)C=CC(=C3)O)C(F)(F)F)Cl PubChem CID 5397219 Molecular Weight 340.68
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 Phenylpropanoids and polyketides Class Isoflavonoids Subclass Isoflav-2-enes Intermediate Tree Nodes Not available Direct Parent Isoflavones Alternative Parents Hydroxyisoflavonoids Chromones Pyranones and derivatives Chlorobenzenes 1-hydroxy-2-unsubstituted benzenoids Aryl chlorides Heteroaromatic compounds Oxacyclic compounds Organooxygen compounds Organofluorides Organochlorides Organic oxides Hydrocarbon derivatives Alkyl fluorides Molecular Framework Aromatic heteropolycyclic compounds Substituents Hydroxyisoflavonoid - Isoflavone - Chromone - Benzopyran - 1-benzopyran - 1-hydroxy-2-unsubstituted benzenoid - Chlorobenzene - Pyranone - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Pyran - Heteroaromatic compound - Oxacycle - Organoheterocyclic compound - Organofluoride - Organooxygen compound - Alkyl halide - Alkyl fluoride - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organochloride - Organohalogen compound - Aromatic heteropolycyclic compound Description This compound belongs to the class of organic compounds known as isoflavones. These are polycyclic compounds containing a 2-isoflavene skeleton which bears a ketone group at the C4 carbon 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.
3D Structure Associated Targets(Human) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Molecular Weight 340.680 g/mol XLogP3 4.300 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 6 Rotatable Bond Count 1 Exact Mass 340.011 Da Monoisotopic Mass 340.011 Da Topological Polar Surface Area 46.500 Ų Heavy Atom Count 23 Formal Charge 0 Complexity 517.000 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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