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· · COA & SDS available for every product · Same-day shipping on in-stock items 4-Butylamino-chromen-2-one , CAS No.21315-46-8
Synonyms
4-Butylamino-chromen-2-one | 4-(butylamino)-2H-chromen-2-one | 4-(butylamino)chromen-2-one | 4-butylaminocoumarin | MLS000523594 | 4-butylaminochromen-2-one | DTXSID20373041 | HMS2354H04 | WAA31546 | STK224841 | AKOS000639844 | AS-58955 | SMR000122667 | F
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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
4-Butylamino-chromen-2-one | 4-(butylamino)-2H-chromen-2-one | 4-(butylamino)chromen-2-one | 4-butylaminocoumarin | MLS000523594 | 4-butylaminochromen-2-one | DTXSID20373041 | HMS2354H04 | WAA31546 | STK224841 | AKOS000639844 | AS-58955 | SMR000122667 | F
Product Properties Names and Identifiers Canonical Smiles CCCCNC1=CC(=O)OC2=CC=CC=C21 IUPAC Name 4-(butylamino)chromen-2-one InChIKey YPFALCOQVSMNOG-UHFFFAOYSA-N INCHI 1S/C13H15NO2/c1-2-3-8-14-11-9-13(15)16-12-7-5-4-6-10(11)12/h4-7,9,14H,2-3,8H2,1H3 Isomeric SMILES CCCCNC1=CC(=O)OC2=CC=CC=C21 PubChem CID 2754632 Molecular Weight 217.26
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 Secondary alkylarylamines Pyranones and derivatives Benzenoids Vinylogous amides Heteroaromatic compounds Lactones Oxacyclic compounds Organopnictogen compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives Molecular Framework Aromatic heteropolycyclic compounds Substituents Coumarin - Benzopyran - 1-benzopyran - Pyranone - Secondary aliphatic/aromatic amine - Pyran - Benzenoid - Heteroaromatic compound - Vinylogous amide - Lactone - Oxacycle - Secondary amine - Organoheterocyclic compound - Amine - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen 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 217.260 g/mol XLogP3 2.900 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 3 Rotatable Bond Count 4 Exact Mass 217.11 Da Monoisotopic Mass 217.11 Da Topological Polar Surface Area 38.300 Ų Heavy Atom Count 16 Formal Charge 0 Complexity 286.000 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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