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· · COA & SDS Disponible para cada producto · Same-day shipping on in-stock items Ethyl 4-methyloxazole-5-carboxylate - ≥98% , CAS No.20485-39-6
Synonyms
ethyl4-methyloxazole-5-carboxylate | Benzenamine, 2,5-bis(trifluoromethyl)- | EC 243-848-9 | UNII-IKW37IL2S5 | IKW37IL2S5 | 4-methyl-5-oxazolecarboxylic acid ethyl ester | InChI=1/C7H9NO3/c1-3-10-7(9)6-5(2)8-4-11-6/h4H,3H2,1-2H | 4-Methyl-oxazole-5-carbox
Storage
Argon charged,Room temperature
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Why this grade ≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Argon charged,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.
Specifications Sinónimos
ethyl4-methyloxazole-5-carboxylate | Benzenamine, 2, 5-bis(trifluoromethyl)- | EC 243-848-9 | UNII-IKW37IL2S5 | IKW37IL2S5 | 4-methyl-5-oxazolecarboxylic acid ethyl ester | InChI=1/C7H9NO3/c1-3-10-7(9)6-5(2)8-4-11-6/h4H, 3H2, 1-2H | 4-Methyl-oxazole-5-carbox
Especificaciones y pureza
≥98%
Condiciones de almacenamiento de almacenamiento
Argon charged, Room temperature
Nombres e identificadores Pubchem Sid 504755950 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/504755950 Sonrisas canónicas CCOC(=O)C1=C(N=CO1)C IUPAC Name ethyl 4-methyl-1,3-oxazole-5-carboxylate InChIKey XNMORZSEENWFLI-UHFFFAOYSA-N INCHI 1S/C7H9NO3/c1-3-10-7(9)6-5(2)8-4-11-6/h4H,3H2,1-2H3 Isómeros SMILES CCOC(=O)C1=C(N=CO1)C Peso molecular 155.2 Reaxy-Rn 510956 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=510956&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 Clase Azoles Subclass Oxazoles Intermediate Tree Nodes Not available Direct Parent 4,5-disubstituted oxazoles Alternative Parents Heteroaromatic compounds Carboxylic acid esters Oxacyclic compounds Monocarboxylic acids and derivatives Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Molecular Framework Aromatic heteromonocyclic compounds Substituents 4,5-disubstituted 1,3-oxazole - Heteroaromatic compound - Carboxylic acid ester - Oxacycle - Azacycle - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic heteromonocyclic compound Descripción This compound belongs to the class of organic compounds known as 4,5-disubstituted oxazoles. These are compounds containing an oxazole ring substituted at positions 4 and 5 only. Oxazole is a five-membered aromatic heterocycle with one oxygen, one nitrogen, and three carbon atoms. Isomers include 1,2-oxazole and 1,3-oxazole. 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.
Estructura 3D Certificados (CoA, COO, BSE/TSE y tabla de análisis) Propiedades químicas y físicas Sensibilidad Air Sensitive Índice de refracción 1.47 Punto de inflamación (°C) 96 °C Punto de ebullición (°C) 62 °C/1.5 mmHg Peso molecular 155.150 g/mol XLogP3 1.300 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 4 Rotatable Bond Count 3 Exact Mass 155.058 Da Monoisotopic Mass 155.058 Da Topological Polar Surface Area 52.300 Ų Heavy Atom Count 11 Formal Charge 0 Complexity 149.000 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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