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· · COA & SDS Disponible para cada producto · Same-day shipping on in-stock items 4-acetil-5-oxohexanoato de etilo - ≥96%(GC) , CAS No.2832-10-2
Synonyms
MFCD00009211 | STK400154 | Hexanoic acid,4-acetyl-5-oxo-, ethyl ester | CAA83210 | DTXSID30370046 | 4,4-Diacetylbutyric Acid Ethyl Ester | AKOS004115443 | FT-0626068 | bromhexinehydrochloride | J-017042 | SCHEMBL1406208 | 4-Acetyl-5-oxohexanoic Acid Ethyl
Storage
Room temperature,Desiccated
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Why this grade ≥96%(GC) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Room temperature,Desiccated 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 Sinónimos
MFCD00009211 | STK400154 | Hexanoic acid, 4-acetyl-5-oxo-, ethyl ester | CAA83210 | DTXSID30370046 | 4, 4-Diacetylbutyric Acid Ethyl Ester | AKOS004115443 | FT-0626068 | bromhexinehydrochloride | J-017042 | SCHEMBL1406208 | 4-Acetyl-5-oxohexanoic Acid Ethyl
Especificaciones y pureza
≥96%(GC)
Condiciones de almacenamiento de almacenamiento
Room temperature, Desiccated
Nombres e identificadores Sonrisas canónicas CCOC(=O)CCC(C(=O)C)C(=O)C IUPAC Name ethyl 4-acetyl-5-oxohexanoate InChIKey YRSGDLIATOURQO-UHFFFAOYSA-N INCHI 1S/C10H16O4/c1-4-14-10(13)6-5-9(7(2)11)8(3)12/h9H,4-6H2,1-3H3 Isómeros SMILES CCOC(=O)CCC(C(=O)C)C(=O)C Peso molecular 200.23 Beilstein 3757 Reaxy-Rn 1785189 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1785189&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 Lipids and lipid-like molecules Clase Fatty Acyls Subclass Fatty acid esters Intermediate Tree Nodes Not available Direct Parent Fatty acid esters Alternative Parents Beta-diketones Ketones Carboxylic acid esters Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Molecular Framework Aliphatic acyclic compounds Substituents 1,3-diketone - Fatty acid ester - 1,3-dicarbonyl compound - Ketone - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound Descripción This compound belongs to the class of organic compounds known as fatty acid esters. These are carboxylic ester derivatives of a fatty acid. 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.
Estructura 3D Certificados (CoA, COO, BSE/TSE y tabla de análisis) Propiedades químicas y físicas Punto de ebullición (°C) 182°C/48mmHg(lit.) Peso molecular 200.230 g/mol XLogP3 0.400 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 4 Rotatable Bond Count 7 Exact Mass 200.105 Da Monoisotopic Mass 200.105 Da Topological Polar Surface Area 60.400 Ų Heavy Atom Count 14 Formal Charge 0 Complexity 218.000 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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