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· · COA & SDS available for every product · Same-day shipping on in-stock items 3-Benzamidocoumarin , CAS No.2549-08-8
Synonyms
3-benzamidocoumarin | N-(2-oxochromen-3-yl)benzamide | N-(2-oxo-2H-chromen-3-yl)benzamide | MLS000693557 | SMR000285500 | NSC74690 | N-Benzoyl-3-aminocoumarin | Oprea1_164249 | Oprea1_313031 | cid_252608 | BDBM95955 | DTXSID20291291 | N-(2-ketochromen-3-y
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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-benzamidocoumarin | N-(2-oxochromen-3-yl)benzamide | N-(2-oxo-2H-chromen-3-yl)benzamide | MLS000693557 | SMR000285500 | NSC74690 | N-Benzoyl-3-aminocoumarin | Oprea1_164249 | Oprea1_313031 | cid_252608 | BDBM95955 | DTXSID20291291 | N-(2-ketochromen-3-y
Product Properties Names and Identifiers Canonical Smiles C1=CC=C(C=C1)C(=O)NC2=CC3=CC=CC=C3OC2=O IUPAC Name N-(2-oxochromen-3-yl)benzamide InChIKey RXHSXTPNFVSJKM-UHFFFAOYSA-N INCHI 1S/C16H11NO3/c18-15(11-6-2-1-3-7-11)17-13-10-12-8-4-5-9-14(12)20-16(13)19/h1-10H,(H,17,18) Isomeric SMILES C1=CC=C(C=C1)C(=O)NC2=CC3=CC=CC=C3OC2=O Molecular Weight 265.26 Reaxy-Rn 231619 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=231619&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 Coumarins and derivatives Subclass Not available Intermediate Tree Nodes Not available Direct Parent Coumarins and derivatives Alternative Parents 1-benzopyrans Benzamides Benzoyl derivatives Pyranones and derivatives Heteroaromatic compounds Secondary carboxylic acid amides Lactones Oxacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Molecular Framework Aromatic heteropolycyclic compounds Substituents Coumarin - Benzopyran - 1-benzopyran - Benzamide - Benzoic acid or derivatives - Benzoyl - Pyranone - Monocyclic benzene moiety - Benzenoid - Pyran - Heteroaromatic compound - Carboxamide group - Lactone - Secondary carboxylic acid amide - Oxacycle - Carboxylic acid derivative - Organoheterocyclic compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organooxygen compound - Organic oxygen compound - 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 265.260 g/mol XLogP3 3.000 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 3 Rotatable Bond Count 2 Exact Mass 265.074 Da Monoisotopic Mass 265.074 Da Topological Polar Surface Area 55.400 Ų Heavy Atom Count 20 Formal Charge 0 Complexity 423.000 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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