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· · COA & SDS Disponible para cada producto · Same-day shipping on in-stock items Ethyl 5-(4-methoxyphenyl)isoxazole-3-carboxylate - ≥98% , CAS No.925006-96-8
Synonyms
Ethyl5-(4-methoxyphenyl)isoxazole-3-carboxylate | DTXSID60650186 | MFCD08446406 | C77170 | Ethyl 5-(4-methoxyphenyl)-isoxazole-3-carboxylate | Ethyl 5-(4-methoxyphenyl)isoxazole-3-carboxylate | OHKWTCCYUHOKLC-UHFFFAOYSA-N | 3-ethoxycarbonyl-5-(4-methoxyph
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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.
Specifications Sinónimos
Ethyl5-(4-methoxyphenyl)isoxazole-3-carboxylate | DTXSID60650186 | MFCD08446406 | C77170 | Ethyl 5-(4-methoxyphenyl)-isoxazole-3-carboxylate | Ethyl 5-(4-methoxyphenyl)isoxazole-3-carboxylate | OHKWTCCYUHOKLC-UHFFFAOYSA-N | 3-ethoxycarbonyl-5-(4-methoxyph
Especificaciones y pureza
≥98%
Condiciones de almacenamiento de almacenamiento
Room temperature
Nombres e identificadores Pubchem Sid 504770064 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/504770064 Sonrisas canónicas CCOC(=O)C1=NOC(=C1)C2=CC=C(C=C2)OC IUPAC Name ethyl 5-(4-methoxyphenyl)-1,2-oxazole-3-carboxylate InChIKey OHKWTCCYUHOKLC-UHFFFAOYSA-N INCHI 1S/C13H13NO4/c1-3-17-13(15)11-8-12(18-14-11)9-4-6-10(16-2)7-5-9/h4-8H,3H2,1-2H3 Isómeros SMILES CCOC(=O)C1=NOC(=C1)C2=CC=C(C=C2)OC Peso molecular 247.25 Reaxy-Rn 10254713 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=10254713&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 Benzenoids Clase Phenol ethers Subclass Anisoles Intermediate Tree Nodes Not available Direct Parent Anisoles Alternative Parents Phenoxy compounds Methoxybenzenes Alkyl aryl ethers Isoxazoles Heteroaromatic compounds Carboxylic acid esters Oxacyclic compounds Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Molecular Framework Aromatic heteromonocyclic compounds Substituents Phenoxy compound - Anisole - Methoxybenzene - Alkyl aryl ether - Monocyclic benzene moiety - Azole - Heteroaromatic compound - Isoxazole - Carboxylic acid ester - Carboxylic acid derivative - Oxacycle - Ether - Azacycle - Organoheterocyclic compound - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Aromatic heteromonocyclic compound Descripción This compound belongs to the class of organic compounds known as anisoles. These are organic compounds containing a methoxybenzene or a derivative thereof. 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 Peso molecular 247.250 g/mol XLogP3 2.600 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 5 Rotatable Bond Count 5 Exact Mass 247.084 Da Monoisotopic Mass 247.084 Da Topological Polar Surface Area 61.600 Ų Heavy Atom Count 18 Formal Charge 0 Complexity 276.000 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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