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· · COA & SDS Disponible para cada producto · Same-day shipping on in-stock items 3，4-Dihydroxyphenylacetic Acid Methyl Ester - ≥98%(GC) , CAS No.25379-88-8
Synonyms
methyl (3,4-dihydroxyphenyl)acetate | SCHEMBL3668882 | Methyl 3,4-dihydroxyphenylacetate | Methyl2-(3,4-dihydroxyphenyl)acetate | D2734 | ERGOLINE-8-CARBOXYLICACIDMETHYLESTER | AKOS015900183 | (3,4-dihydroxyphenyl)-acetic acid methyl ester | A817833 | PD1
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Why this grade ≥98%(GC) 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
methyl (3, 4-dihydroxyphenyl)acetate | SCHEMBL3668882 | Methyl 3, 4-dihydroxyphenylacetate | Methyl2-(3, 4-dihydroxyphenyl)acetate | D2734 | ERGOLINE-8-CARBOXYLICACIDMETHYLESTER | AKOS015900183 | (3, 4-dihydroxyphenyl)-acetic acid methyl ester | A817833 | PD1
Especificaciones y pureza
≥98%(GC)
Condiciones de almacenamiento de almacenamiento
Room temperature
Nombres e identificadores Pubchem Sid 488197049 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/488197049 Sonrisas canónicas COC(=O)CC1=CC(=C(C=C1)O)O IUPAC Name methyl 2-(3,4-dihydroxyphenyl)acetate InChIKey UGFILLIGHGZLHE-UHFFFAOYSA-N INCHI 1S/C9H10O4/c1-13-9(12)5-6-2-3-7(10)8(11)4-6/h2-4,10-11H,5H2,1H3 Isómeros SMILES COC(=O)CC1=CC(=C(C=C1)O)O Peso molecular 182.18 Beilstein 10(4)1509 Reaxy-Rn 2834564 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2834564&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 Phenols Subclass Benzenediols Intermediate Tree Nodes Not available Direct Parent Catechols Alternative Parents 1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids Benzene and substituted derivatives Methyl esters Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds Molecular Framework Aromatic homomonocyclic compounds Substituents Catechol - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Monocyclic benzene moiety - Methyl ester - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aromatic homomonocyclic compound Descripción This compound belongs to the class of organic compounds known as catechols. These are compounds containing a 1,2-benzenediol moiety. 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 Objetivos asociados (no humanos) Mecanismos de acción Certificados (CoA, COO, BSE/TSE y tabla de análisis) Propiedades químicas y físicas Punto de fusión (°C) 55 °C Peso molecular 182.170 g/mol XLogP3 0.800 Hydrogen Bond Donor Count 2 Hydrogen Bond Acceptor Count 4 Rotatable Bond Count 3 Exact Mass 182.058 Da Monoisotopic Mass 182.058 Da Topological Polar Surface Area 66.800 Ų Heavy Atom Count 13 Formal Charge 0 Complexity 180.000 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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