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· · COA & SDS available for every product · Same-day shipping on in-stock items 6-Methyl-4-phenyl-2-chromanone - ≥98% , CAS No.40546-94-9
Synonyms
SY036927 | 6-Methyl-4-phenyl-2-chromanone | SUHIZPDCJOQZLN-UHFFFAOYSA-N | SCHEMBL820663 | M2093 | rac-6-Methyl-4-phenylchroman-2-one | 6-methyl-4-phenyl-chroman-one | A6781 | 2H-1-Benzopyran-2-one, 3,4-dihydro-6-methyl-4-phenyl- | FT-0639650 | FT-0672138
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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 Synonyms
SY036927 | 6-Methyl-4-phenyl-2-chromanone | SUHIZPDCJOQZLN-UHFFFAOYSA-N | SCHEMBL820663 | M2093 | rac-6-Methyl-4-phenylchroman-2-one | 6-methyl-4-phenyl-chroman-one | A6781 | 2H-1-Benzopyran-2-one, 3, 4-dihydro-6-methyl-4-phenyl- | FT-0639650 | FT-0672138
Specifications & Purity
≥98%
Names and Identifiers Pubchem Sid 488194569 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/488194569 Canonical Smiles CC1=CC2=C(C=C1)OC(=O)CC2C3=CC=CC=C3 IUPAC Name 6-methyl-4-phenyl-3,4-dihydrochromen-2-one InChIKey SUHIZPDCJOQZLN-UHFFFAOYSA-N INCHI 1S/C16H14O2/c1-11-7-8-15-14(9-11)13(10-16(17)18-15)12-5-3-2-4-6-12/h2-9,13H,10H2,1H3 Isomeric SMILES CC1=CC2=C(C=C1)OC(=O)CC2C3=CC=CC=C3 Molecular Weight 238.29 Reaxy-Rn 191428 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=191428&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 Phenylpropanoids and polyketides Class Neoflavonoids Subclass Neoflavans Intermediate Tree Nodes Not available Direct Parent Neoflavans Alternative Parents 3,4-dihydrocoumarins 1-benzopyrans Benzene and substituted derivatives Lactones Carboxylic acid esters Oxacyclic compounds Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds Molecular Framework Aromatic heteropolycyclic compounds Substituents Neoflavan - 3,4-dihydrocoumarin - Chromane - Benzopyran - 1-benzopyran - Monocyclic benzene moiety - Benzenoid - Lactone - Carboxylic acid ester - Oxacycle - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organoheterocyclic compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic heteropolycyclic compound Description This compound belongs to the class of organic compounds known as neoflavans. These are neoflavonoids with a structure based on a 3,4-dihydro-4-aryl-2H-1-benzopyran skeleton. 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 Boil Point(°C) 230°C/16mmHg Melt Point(°C) 82 °C Molecular Weight 238.280 g/mol XLogP3 3.500 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 2 Rotatable Bond Count 1 Exact Mass 238.099 Da Monoisotopic Mass 238.099 Da Topological Polar Surface Area 26.300 Ų Heavy Atom Count 18 Formal Charge 0 Complexity 306.000 Isotope Atom Count 0 Defined Atom Stereocenter Count 0 Undefined Atom Stereocenter Count 1 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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