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· · COA & SDS available for every product · Same-day shipping on in-stock items Ethyl 2-Acetyl-3-(dimethylamino)acrylate - ≥95% , CAS No.51145-57-4
Synonyms
LQSOVGAUOHMPLK-SOFGYWHQSA-N | A7561 | Ethyl (E)-2-((dimethylamino)methylene)-3-oxobutanoate | AC-23241 | AKOS025310760 | AKOS005070346 | ethyl (2E)-2-(dimethylaminomethylidene)-3-oxobutanoate | Butanoic acid, 2-[(dimethylamino)methylene]-3-oxo-, ethyl est
Storage
Store at 2-8°C,Argon charged
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Why this grade ≥95% 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
LQSOVGAUOHMPLK-SOFGYWHQSA-N | A7561 | Ethyl (E)-2-((dimethylamino)methylene)-3-oxobutanoate | AC-23241 | AKOS025310760 | AKOS005070346 | ethyl (2E)-2-(dimethylaminomethylidene)-3-oxobutanoate | Butanoic acid, 2-[(dimethylamino)methylene]-3-oxo-, ethyl est
Specifications & Purity
≥95%
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 Canonical Smiles CCOC(=O)C(=CN(C)C)C(=O)C IUPAC Name ethyl (2E)-2-(dimethylaminomethylidene)-3-oxobutanoate InChIKey LQSOVGAUOHMPLK-SOFGYWHQSA-N INCHI 1S/C9H15NO3/c1-5-13-9(12)8(7(2)11)6-10(3)4/h6H,5H2,1-4H3/b8-6+ Isomeric SMILES CCOC(=O)/C(=C/N(C)C)/C(=O)C Molecular Weight 185.22 Reaxy-Rn 1935452 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1935452&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 Beta-keto acids and derivatives Intermediate Tree Nodes Not available Direct Parent Beta-keto acids and derivatives Alternative Parents Fatty acid esters Alpha-branched alpha,beta-unsaturated ketones Vinylogous amides Enones Enoate esters Acryloyl compounds Trialkylamines Ketones Amino acids and derivatives Monocarboxylic acids and derivatives Enamines Allylamines Organopnictogen compounds Organic oxides Hydrocarbon derivatives Molecular Framework Aliphatic acyclic compounds Substituents Beta-keto acid - Fatty acid ester - Fatty acyl - Alpha-branched alpha,beta-unsaturated-ketone - Acryloyl-group - Enone - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Vinylogous amide - Alpha,beta-unsaturated ketone - Amino acid or derivatives - Carboxylic acid ester - Ketone - Tertiary amine - Tertiary aliphatic amine - Monocarboxylic acid or derivatives - Enamine - Carboxylic acid derivative - Allylamine - Organonitrogen compound - Amine - Organic oxide - Organopnictogen compound - Carbonyl group - Organooxygen compound - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Aliphatic acyclic compound Description This compound belongs to the class of organic compounds known as beta-keto acids and derivatives. These are organic compounds containing an aldehyde substituted with a keto group on the C3 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.
3D Structure Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Sensitivity air & Moisture sensitive Refractive Index 1.53 Flash Point(°C) 103 °C Boil Point(°C) 150℃ Molecular Weight 185.220 g/mol XLogP3 0.700 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 4 Rotatable Bond Count 5 Exact Mass 185.105 Da Monoisotopic Mass 185.105 Da Topological Polar Surface Area 46.600 Ų Heavy Atom Count 13 Formal Charge 0 Complexity 231.000 Isotope Atom Count 0 Defined Atom Stereocenter Count 0 Undefined Atom Stereocenter Count 0 Defined Bond Stereocenter Count 1 Undefined Bond Stereocenter Count 0 The total count of all stereochemical bonds 1 Covalently-Bonded Unit Count 1
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