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· · COA & SDS Disponible para cada producto · Same-day shipping on in-stock items ETHYL 4-METHYL-2,3,5-TRIOXO-1-CYCLOPENTANEGLYOXYLATE , CAS No.39163-39-8
Synonyms
ethyl 2-oxo-2-(2-oxocyclopentyl)acetate|39163-39-8|ethyl oxo(2-oxocyclopentyl)acetate|CYCLOPENTANEACETIC ACID, A,2-DIOXO-, ETHYL ESTER|MFCD00019311|Ethyl oxo(2-oxocyclopent-1-yl)acetate|NSC74476|SCHEMBL5109918|DTXSID40291253|SYJZOWMPITUCHW-UHFFFAOYSA-N|et
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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 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
ethyl 2-oxo-2-(2-oxocyclopentyl)acetate | 39163-39-8 | ethyl oxo(2-oxocyclopentyl)acetate | CYCLOPENTANEACETIC ACID, A, 2-DIOXO-, ETHYL ESTER | MFCD00019311 | Ethyl oxo(2-oxocyclopent-1-yl)acetate | NSC74476 | SCHEMBL5109918 | DTXSID40291253 | SYJZOWMPITUCHW-UHFFFAOYSA-N | et
Condiciones de almacenamiento de almacenamiento
Room temperature
Nombres e identificadores Sonrisas canónicas CCOC(=O)C(=O)C1CCCC1=O IUPAC Name ethyl 2-oxo-2-(2-oxocyclopentyl)acetate InChIKey SYJZOWMPITUCHW-UHFFFAOYSA-N INCHI 1S/C9H12O4/c1-2-13-9(12)8(11)6-4-3-5-7(6)10/h6H,2-5H2,1H3 Isómeros SMILES CCOC(=O)C(=O)C1CCCC1=O Peso molecular 184.194 Reaxy-Rn 1875261 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1875261&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 Organic oxygen compounds Clase Organooxygen compounds Subclass Carbonyl compounds Intermediate Tree Nodes 1,3-dicarbonyl compounds Direct Parent Beta-diketones Alternative Parents Alpha-keto acids and derivatives Cyclic ketones Carboxylic acid esters Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Molecular Framework Aliphatic homomonocyclic compounds Substituents 1,3-diketone - Keto acid - Alpha-keto acid - Cyclic ketone - Ketone - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxide - Hydrocarbon derivative - Aliphatic homomonocyclic compound Descripción This compound belongs to the class of organic compounds known as beta-diketones. These are organic compounds containing two keto groups separated by a single carbon atom. 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 Peso molecular 184.190 g/mol XLogP3 0.800 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 4 Rotatable Bond Count 4 Exact Mass 184.074 Da Monoisotopic Mass 184.074 Da Topological Polar Surface Area 60.400 Ų Heavy Atom Count 13 Formal Charge 0 Complexity 244.000 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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