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· · COA & SDS available for every product · Same-day shipping on in-stock items 7-Acetoxycoumarin , CAS No.10387-49-2
Synonyms
7-acetoxycoumarin | (2-oxochromen-7-yl) acetate | 2H-1-Benzopyran-2-one, 7-(acetyloxy)- | 2-oxo-2H-chromen-7-yl acetate | 7-(Acetyloxy)-2H-1-benzopyran-2-one | Coumarin, 7-hydroxy-, acetate | 2H-1-Benzopyran-2-one,7-(acetyloxy)- | MLS001049006 | SMR000387
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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
7-acetoxycoumarin | (2-oxochromen-7-yl) acetate | 2H-1-Benzopyran-2-one, 7-(acetyloxy)- | 2-oxo-2H-chromen-7-yl acetate | 7-(Acetyloxy)-2H-1-benzopyran-2-one | Coumarin, 7-hydroxy-, acetate | 2H-1-Benzopyran-2-one, 7-(acetyloxy)- | MLS001049006 | SMR000387
Product Properties Names and Identifiers Canonical Smiles CC(=O)OC1=CC2=C(C=C1)C=CC(=O)O2 IUPAC Name (2-oxochromen-7-yl) acetate InChIKey MGZOXZPZHVOXQB-UHFFFAOYSA-N INCHI 1S/C11H8O4/c1-7(12)14-9-4-2-8-3-5-11(13)15-10(8)6-9/h2-6H,1H3 Isomeric SMILES CC(=O)OC1=CC2=C(C=C1)C=CC(=O)O2 PubChem CID 928228 Molecular Weight 204.18
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 Coumarins and derivatives Subclass Not available Intermediate Tree Nodes Not available Direct Parent Coumarins and derivatives Alternative Parents 1-benzopyrans Pyranones and derivatives Benzenoids Heteroaromatic compounds Lactones Carboxylic acid esters Oxacyclic compounds Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds Molecular Framework Aromatic heteropolycyclic compounds Substituents Coumarin - Benzopyran - 1-benzopyran - Pyranone - Pyran - Benzenoid - Heteroaromatic compound - Carboxylic acid ester - Lactone - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Oxacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organooxygen compound - Organic oxygen compound - Organic oxide - Carbonyl group - Aromatic heteropolycyclic compound Description This compound belongs to the class of organic compounds known as coumarins and derivatives. These are polycyclic aromatic compounds containing a 1-benzopyran moiety with a ketone group at the C2 carbon atom (1-benzopyran-2-one). 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) Associated Targets(non-human) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Molecular Weight 204.180 g/mol XLogP3 1.700 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 4 Rotatable Bond Count 2 Exact Mass 204.042 Da Monoisotopic Mass 204.042 Da Topological Polar Surface Area 52.600 Ų Heavy Atom Count 15 Formal Charge 0 Complexity 308.000 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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