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· · COA & SDS Disponible para cada producto · Same-day shipping on in-stock items Methyl 3-ethoxybenzoate - ≥98% , CAS No.108593-47-1
Synonyms
BS-23614 | A895243 | 3-ethoxy-benzoic-acid-methyl-ester | IFLQNIVRGRISMD-UHFFFAOYSA-N | 3-Ethoxybenzoic acid methyl ester | 3-Ethoxy-benzoic acid methyl ester | DTXSID60390853 | E85369 | MFCD00017263 | methyl 3-ethoxybenzoate | Benzoic acid, 3-ethoxy-, me
Storage
Desiccated,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 Desiccated,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
BS-23614 | A895243 | 3-ethoxy-benzoic-acid-methyl-ester | IFLQNIVRGRISMD-UHFFFAOYSA-N | 3-Ethoxybenzoic acid methyl ester | 3-Ethoxy-benzoic acid methyl ester | DTXSID60390853 | E85369 | MFCD00017263 | methyl 3-ethoxybenzoate | Benzoic acid, 3-ethoxy-, me
Especificaciones y pureza
≥98%
Condiciones de almacenamiento de almacenamiento
Desiccated, Room temperature
Nombres e identificadores Pubchem Sid 504762515 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/504762515 Sonrisas canónicas CCOC1=CC=CC(=C1)C(=O)OC IUPAC Name methyl 3-ethoxybenzoate InChIKey IFLQNIVRGRISMD-UHFFFAOYSA-N INCHI 1S/C10H12O3/c1-3-13-9-6-4-5-8(7-9)10(11)12-2/h4-7H,3H2,1-2H3 Isómeros SMILES CCOC1=CC=CC(=C1)C(=O)OC Peso molecular 180.2 Reaxy-Rn 3089953 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3089953&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 Benzene and substituted derivatives Subclass Benzoic acids and derivatives Intermediate Tree Nodes Not available Direct Parent Benzoic acid esters Alternative Parents Phenoxy compounds Phenol ethers Benzoyl derivatives Alkyl aryl ethers Methyl esters Organic oxides Hydrocarbon derivatives Molecular Framework Aromatic homomonocyclic compounds Substituents Benzoate ester - Phenoxy compound - Phenol ether - Benzoyl - Alkyl aryl ether - Methyl ester - Carboxylic acid ester - Ether - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aromatic homomonocyclic compound Descripción This compound belongs to the class of organic compounds known as benzoic acid esters. These are ester derivatives of benzoic acid. 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 180.200 g/mol XLogP3 2.600 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 3 Rotatable Bond Count 4 Exact Mass 180.079 Da Monoisotopic Mass 180.079 Da Topological Polar Surface Area 35.500 Ų Heavy Atom Count 13 Formal Charge 0 Complexity 168.000 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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