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· · COA & SDS available for every product · Same-day shipping on in-stock items ethyl 4-cyclopropyl-2,4-dioxobutanoate - ≥97% , CAS No.21080-80-8
Synonyms
ethyl 4-cyclopropyl-2,4-dioxobutanoate | MFCD09052462 | 4-CYCLOPROPYL-2,4-DIOXO-BUTYRIC ACID ETHYL ESTER | BS-13825 | MHKXVJFDESXWFH-UHFFFAOYSA-N | cyclopropanebutanoic acid, alpha,gamma-dioxo-, ethyl ester | EN300-41906 | SY117217 | s11877 | SCHEMBL16943
Storage
Store at 2-8°C,Argon charged
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Why this grade ≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Store at 2-8°C,Argon charged Ships Wet ice 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
ethyl 4-cyclopropyl-2, 4-dioxobutanoate | MFCD09052462 | 4-CYCLOPROPYL-2, 4-DIOXO-BUTYRIC ACID ETHYL ESTER | BS-13825 | MHKXVJFDESXWFH-UHFFFAOYSA-N | cyclopropanebutanoic acid, alpha, gamma-dioxo-, ethyl ester | EN300-41906 | SY117217 | s11877 | SCHEMBL16943
Specifications & Purity
≥97%
Storage
Store at 2-8°C, Argon charged
Shipped In
Wet ice
This product requires cold chain shipping. Ground and other economy services are not available.
Names and Identifiers Pubchem Sid 504768543 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/504768543 Canonical Smiles CCOC(=O)C(=O)CC(=O)C1CC1 IUPAC Name ethyl 4-cyclopropyl-2,4-dioxobutanoate InChIKey MHKXVJFDESXWFH-UHFFFAOYSA-N INCHI 1S/C9H12O4/c1-2-13-9(12)8(11)5-7(10)6-3-4-6/h6H,2-5H2,1H3 Isomeric SMILES CCOC(=O)C(=O)CC(=O)C1CC1 Molecular Weight 184.19 Reaxy-Rn 3130460 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3130460&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 acids and derivatives Class Keto acids and derivatives Subclass Gamma-keto acids and derivatives Intermediate Tree Nodes Not available Direct Parent 3-Acylpyruvic acids Alternative Parents Fatty acid esters Beta-diketones Alpha-keto acids and derivatives Ketones Carboxylic acid esters Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Molecular Framework Aliphatic homomonocyclic compounds Substituents 3-acylpyruvic acid - 1,3-diketone - Fatty acid ester - Alpha-keto acid - Fatty acyl - 1,3-dicarbonyl compound - Carboxylic acid ester - Ketone - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organic oxygen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Aliphatic homomonocyclic compound Description This compound belongs to the class of organic compounds known as 3-acylpyruvic acids. These are compounds containing a pyruvic acid substituted at the 3-position by an acyl group. 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 Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Molecular Weight 184.190 g/mol XLogP3 0.700 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 4 Rotatable Bond Count 6 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 240.000 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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