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· · COA & SDS Disponible para cada producto · Same-day shipping on in-stock items Dimethyl 4-Hydroxyisophthalate - ≥97%(GC) , CAS No.5985-24-0
Synonyms
EINECS 227-803-0 | NSC-51803 | CCG-266647 | 4-HYDROXYISOPHTHALIC ACID DIMETHYL ESTER [MI] | AKOS001039205 | NSC 109108 | 4-Hydroxy isophthalic acid dimethyl ester | 1,3-Benzenedicarboxylic acid, 4-hydroxy-, 1,3-dimethyl ester | 1,3-Benzenedicarboxylic aci
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Why this grade ≥97%(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
EINECS 227-803-0 | NSC-51803 | CCG-266647 | 4-HYDROXYISOPHTHALIC ACID DIMETHYL ESTER [MI] | AKOS001039205 | NSC 109108 | 4-Hydroxy isophthalic acid dimethyl ester | 1, 3-Benzenedicarboxylic acid, 4-hydroxy-, 1, 3-dimethyl ester | 1, 3-Benzenedicarboxylic aci
Especificaciones y pureza
≥97%(GC)
Condiciones de almacenamiento de almacenamiento
Room temperature
Nombres e identificadores Pubchem Sid 488185815 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/488185815 Sonrisas canónicas COC(=O)C1=CC(=C(C=C1)O)C(=O)OC IUPAC Name dimethyl 4-hydroxybenzene-1,3-dicarboxylate InChIKey ALBUJVBOIXVVLS-UHFFFAOYSA-N INCHI 1S/C10H10O5/c1-14-9(12)6-3-4-8(11)7(5-6)10(13)15-2/h3-5,11H,1-2H3 Isómeros SMILES COC(=O)C1=CC(=C(C=C1)O)C(=O)OC Peso molecular 210.19 Beilstein 10(4)2093 Reaxy-Rn 2116336 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2116336&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 Phthalic acid and derivatives - Phthalate esters Direct Parent m-Phthalate esters Alternative Parents M-phthalic acid and derivatives p-Hydroxybenzoic acid alkyl esters o-Hydroxybenzoic acid esters Salicylic acid and derivatives Benzoyl derivatives 1-hydroxy-2-unsubstituted benzenoids Dicarboxylic acids and derivatives Vinylogous acids Methyl esters Organooxygen compounds Organic oxides Hydrocarbon derivatives Molecular Framework Aromatic homomonocyclic compounds Substituents Meta-phthalic acid ester - Meta_phthalic_acid - P-hydroxybenzoic acid alkyl ester - P-hydroxybenzoic acid ester - O-hydroxybenzoic acid ester - Benzoate ester - Salicylic acid or derivatives - Benzoyl - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Dicarboxylic acid or derivatives - Vinylogous acid - Methyl ester - Carboxylic acid ester - Carboxylic acid derivative - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organic oxygen compound - Aromatic homomonocyclic compound Descripción This compound belongs to the class of organic compounds known as m-phthalate esters. These are ester derivatives of m-phthalic acids, which are based on a benzene 1,3-dicarboxylic acid skeleton. 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 Solubilidad Soluble in ethanol, and acetone. Insoluble in water. Punto de fusión (°C) 95.0 - 99.0 °C Peso molecular 210.180 g/mol XLogP3 2.200 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 5 Rotatable Bond Count 4 Exact Mass 210.053 Da Monoisotopic Mass 210.053 Da Topological Polar Surface Area 72.800 Ų Heavy Atom Count 15 Formal Charge 0 Complexity 250.000 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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