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· · COA & SDS Disponibile per ogni prodotto · Spedizione lo stesso giorno su articoli in magazzino Ethyl 3-coumarincarboxylate - ≥98% , CAS No.1846-76-0
Synonyms
Ethyl 3-coumarincarboxylate | Maybridge1_001094 | 1,2-Benzopyran-2-one-3-carboxylic acid, ethyl ester | Ethyl 3-coumarincarboxylate, 99% | HY-W014081 | J-011833 | Propionic acid 2-oxo-2H-chromen-3-yl ester | 2-OXO-2H, ETHYL ESTER | ETHYL 2H-2-OXO-1-BENZOP
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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 1 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Specifications Sinonimi
Ethyl 3-coumarincarboxylate | Maybridge1_001094 | 1,2-Benzopyran-2-one-3-carboxylic acid, ethyl ester | Ethyl 3-coumarincarboxylate, 99% | HY-W014081 | J-011833 | Propionic acid 2-oxo-2H-chromen-3-yl ester | 2-OXO-2H, ETHYL ESTER | ETHYL 2H-2-OXO-1-BENZOP
Condizioni di conservazione di stoccaggio
Room temperature
Nomi e identificatori Pubchem Sid 504752711 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/504752711 Sorrisi canonici CCOC(=O)C1=CC2=CC=CC=C2OC1=O IUPAC Name ethyl 2-oxochromene-3-carboxylate InChIKey XKHPEMKBJGUYCM-UHFFFAOYSA-N INCHI 1S/C12H10O4/c1-2-15-11(13)9-7-8-5-3-4-6-10(8)16-12(9)14/h3-7H,2H2,1H3 Isomeri SMILES CCOC(=O)C1=CC2=CC=CC=C2OC1=O WGK Germania 3 RTECS DJ2501000 Peso molecolare 218.21 Reaxy-Rn 200147 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=200147&ln=
Documentazione 📋 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 Phenylpropanoids and polyketides Classe Coumarins and derivatives Subclass Not available Intermediate Tree Nodes Not available Direct Parent Coumarins and derivatives Alternative Parents 1-benzopyrans Pyranones and derivatives Benzenoids Heteroaromatic compounds Lactones Carboxylic acid esters Oxacyclic compounds Monocarboxylic acids and derivatives Organooxygen compounds Organic oxides Hydrocarbon derivatives Molecular Framework Aromatic heteropolycyclic compounds Substituents Coumarin - Benzopyran - 1-benzopyran - Pyranone - Pyran - Benzenoid - Heteroaromatic compound - Lactone - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organoheterocyclic compound - Oxacycle - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organic oxide - Aromatic heteropolycyclic compound Descrizione This compound belongs to the class of organic compounds known as coumarins and derivatives. These are polycyclic aromatic compounds containing a 1-benzopyran moiety with a ketone group at the C2 carbon atom (1-benzopyran-2-one). 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.
Struttura 3D Obiettivi associati (non umani) Meccanismi d'azione Certificati (CoA, COO, BSE/TSE e tabella di analisi) Proprietà chimiche e fisiche Punto di fusione (°C) 94 °C Peso molecolare 218.200 g/mol XLogP3 2.300 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 4 Rotatable Bond Count 3 Exact Mass 218.058 Da Monoisotopic Mass 218.058 Da Topological Polar Surface Area 52.600 Ų Heavy Atom Count 16 Formal Charge 0 Complexity 332.000 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
Citations of This Product Riferimenti 1. Wei Zehui, Zhang Jun, Liu Wenxin, Dong Xue, Cheng Yu, Yan Shuangxian, Dong Xinyi, Wang Suhong, Tian Mei. (2024) Preparation and application of a pseudo-templated multi-monomer aflatoxins imprinted polymer. MICROCHIMICA ACTA, 191 (10): (1-13). [PMID:39289224 ] [10.1007/s00604-024-06677-7 ]
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