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· · COA & SDS available for every product · Same-day shipping on in-stock items 2-Cyano-3-ethoxyacrylic Acid Ethyl Ester - ≥98% , CAS No.94-05-3
Synonyms
AKOS000120675 | Ethyl .alpha.-(ethoxymethylene)-.alpha.-cyanoacetate | F0001-2258 | LS-13436 | EINECS 202-299-5 | 2-Propenoic acid, 2-cyano-3-ethoxy-, ethyl ester, (2E)- | ethyl 2-cyano-3-ethoxy-2-propenoate | Ethyl (2E)-2-cyano-3-ethoxy-2-propenoate | Et
Storage
Store at 2-8°C,Argon charged
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Why this grade ≥98% 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.
Overview Ethyl Cyano(ethoxymethylene)acetate is an intermediate in the synthesis of anti-inflammatory agents with gastroprotective effect in rats.
Specifications Synonyms
AKOS000120675 | Ethyl .alpha.-(ethoxymethylene)-.alpha.-cyanoacetate | F0001-2258 | LS-13436 | EINECS 202-299-5 | 2-Propenoic acid, 2-cyano-3-ethoxy-, ethyl ester, (2E)- | ethyl 2-cyano-3-ethoxy-2-propenoate | Ethyl (2E)-2-cyano-3-ethoxy-2-propenoate | Et
Specifications & Purity
≥98%
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 504760623 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/504760623 Canonical Smiles CCOC=C(C#N)C(=O)OCC IUPAC Name ethyl (E)-2-cyano-3-ethoxyprop-2-enoate InChIKey KTMGNAIGXYODKQ-VOTSOKGWSA-N INCHI 1S/C8H11NO3/c1-3-11-6-7(5-9)8(10)12-4-2/h6H,3-4H2,1-2H3/b7-6+ Isomeric SMILES CCO/C=C(\C#N)/C(=O)OCC WGK Germany 1 Molecular Weight 169.18 Beilstein 878814 Reaxy-Rn 878814 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=878814&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 Vinylogous esters Subclass Not available Intermediate Tree Nodes Not available Direct Parent Vinylogous esters Alternative Parents Enoate esters Nitriles Monocarboxylic acids and derivatives Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Molecular Framework Aliphatic acyclic compounds Substituents Vinylogous ester - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Carboxylic acid ester - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Carbonyl group - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Aliphatic acyclic compound Description This compound belongs to the class of organic compounds known as vinylogous esters. These are organic compounds containing an ester group, which is indirectly attached to a carbonyl via an intervening vinyl (>C=C<) moiety. 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 Solubility Solubility in Methanol almost transparency; Sensitivity Moisture sensitive Flash Point(°F) 266°F Flash Point(°C) 130℃ Boil Point(°C) 190-191°C/30 mmHg Melt Point(°C) 47.0 - 53.0℃ Molecular Weight 169.180 g/mol XLogP3 1.000 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 4 Rotatable Bond Count 5 Exact Mass 169.074 Da Monoisotopic Mass 169.074 Da Topological Polar Surface Area 59.300 Ų Heavy Atom Count 12 Formal Charge 0 Complexity 224.000 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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