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· · COA & SDS Disponibile per ogni prodotto · Spedizione lo stesso giorno su articoli in magazzino 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 Sinonimi
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
Condizioni di conservazione di stoccaggio
Desiccated,Room temperature
Nomi e identificatori Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/504762515
Sorrisi canonici
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
Isomeri SMILES
CCOC1=CC=CC(=C1)C(=O)OC
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3089953&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 Benzenoids Classe 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 Descrizione 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.
Struttura 3D Certificati (CoA, COO, BSE/TSE e tabella di analisi) Proprietà chimiche e fisiche Peso molecolare 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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