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· · COA & SDS available for every product · Same-day shipping on in-stock items Ethyl 4-Quinazolone-2-carboxylate - ≥98% , CAS No.29113-33-5
Synonyms
AKOS000321277 | SR-01000459303 | 4-oxo-3H-quinazoline-2-carboxylic acid ethyl ester | HMS1399K08 | GLYCOPYRROLATE COMPONENT OF PREVDUO | J-521057 | 2-ethoxycarbonylquinazolin-4-one | 2-Quinazolinecarboxylicacid,3,4-dihydro-4-oxo-,ethyl ester | 5SF | DTXSI
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Why this grade ≥98% 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.
Overview Ethyl 4-quinazolone-2-carboxylate is a quinazoline derivative. It can be synthesized from anthranilamide and ethyl oxalate.
Specifications Synonyms
AKOS000321277 | SR-01000459303 | 4-oxo-3H-quinazoline-2-carboxylic acid ethyl ester | HMS1399K08 | GLYCOPYRROLATE COMPONENT OF PREVDUO | J-521057 | 2-ethoxycarbonylquinazolin-4-one | 2-Quinazolinecarboxylicacid, 3, 4-dihydro-4-oxo-, ethyl ester | 5SF | DTXSI
Specifications & Purity
≥98%
Names and Identifiers Pubchem Sid 488202897 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/488202897 Canonical Smiles CCOC(=O)C1=NC2=CC=CC=C2C(=O)N1 IUPAC Name ethyl 4-oxo-3H-quinazoline-2-carboxylate InChIKey BMCAWNQKVVTNFP-UHFFFAOYSA-N INCHI 1S/C11H10N2O3/c1-2-16-11(15)9-12-8-6-4-3-5-7(8)10(14)13-9/h3-6H,2H2,1H3,(H,12,13,14) Isomeric SMILES CCOC(=O)C1=NC2=CC=CC=C2C(=O)N1 WGK Germany 3 Molecular Weight 218.21 Reaxy-Rn 190186 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=190186&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 Organoheterocyclic compounds Class Diazanaphthalenes Subclass Benzodiazines Intermediate Tree Nodes Not available Direct Parent Quinazolines Alternative Parents Pyrimidinecarboxylic acids Pyrimidones Benzenoids Vinylogous amides Heteroaromatic compounds Carboxylic acid esters Monocarboxylic acids and derivatives Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Molecular Framework Aromatic heteropolycyclic compounds Substituents Quinazoline - Pyrimidine-2-carboxylic acid - Pyrimidine-2-carboxylic acid or derivatives - Pyrimidone - Benzenoid - Pyrimidine - Heteroaromatic compound - Vinylogous amide - Carboxylic acid ester - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organopnictogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound Description This compound belongs to the class of organic compounds known as quinazolines. These are compounds containing a quinazoline moiety, which is made up of two fused six-member aromatic rings, a benzene ring and a pyrimidine ring. 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 Associated Targets(Human) Associated Targets(non-human) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Melt Point(°C) 192 °C Molecular Weight 218.210 g/mol XLogP3 1.300 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 4 Rotatable Bond Count 3 Exact Mass 218.069 Da Monoisotopic Mass 218.069 Da Topological Polar Surface Area 67.800 Ų Heavy Atom Count 16 Formal Charge 0 Complexity 338.000 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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