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· · COA & SDS disponible pour chaque produit · Expédition le jour même sur les articles en stock Diethyl 2,5-dihydroxyterephthalate - ≥97% , CAS No.5870-38-2
Synonyms
EINECS 227-522-3 | 2,5-dihydroxy terephthalic acid diethyl ester | MFCD00055430 | Terephthalic acid,5-dihydroxy-, diethyl ester | 1,4-Benzenedicarboxylic acid, 2,5-dihydroxy-, 1,4-diethyl ester | NSC 177975 | CCG-103203 | ChemDiv2_000191 | SCHEMBL322149 |
Storage
Room temperature,Argon charged
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Why this grade ≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Room temperature,Argon charged 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 2 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Specifications Synonymes
EINECS 227-522-3 | 2,5-dihydroxy terephthalic acid diethyl ester | MFCD00055430 | Terephthalic acid,5-dihydroxy-, diethyl ester | 1,4-Benzenedicarboxylic acid, 2,5-dihydroxy-, 1,4-diethyl ester | NSC 177975 | CCG-103203 | ChemDiv2_000191 | SCHEMBL322149 |
Spécifications et pureté
≥97%
Conditions de stockage de stockage
Room temperature,Argon charged
Noms et identifiants Pubchem Sid 504755429 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/504755429 Sourires canoniques CCOC(=O)C1=CC(=C(C=C1O)C(=O)OCC)O IUPAC Name diethyl 2,5-dihydroxybenzene-1,4-dicarboxylate InChIKey UQOUOXLHXPHDHF-UHFFFAOYSA-N INCHI 1S/C12H14O6/c1-3-17-11(15)7-5-10(14)8(6-9(7)13)12(16)18-4-2/h5-6,13-14H,3-4H2,1-2H3 Isomères SMILES CCOC(=O)C1=CC(=C(C=C1O)C(=O)OCC)O Poids moléculaire 254.24 Reaxy-Rn 2133359 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2133359&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 Classe Benzene and substituted derivatives Subclass Benzoic acids and derivatives Intermediate Tree Nodes Phthalic acid and derivatives - Phthalate esters Direct Parent p-Phthalate esters Alternative Parents P-phthalic acid and derivatives o-Hydroxybenzoic acid esters m-Hydroxybenzoic acid esters Salicylic acid and derivatives Hydroquinones Benzoyl derivatives 1-hydroxy-2-unsubstituted benzenoids Dicarboxylic acids and derivatives Vinylogous acids Carboxylic acid esters Organooxygen compounds Organic oxides Hydrocarbon derivatives Molecular Framework Aromatic homomonocyclic compounds Substituents Para-phthalic acid ester - Para_phthalic_acid - M-hydroxybenzoic acid ester - O-hydroxybenzoic acid ester - Dihydroxybenzoic acid - Benzoate ester - Salicylic acid or derivatives - Benzoyl - Hydroquinone - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Dicarboxylic acid or derivatives - Vinylogous acid - Carboxylic acid ester - Carboxylic acid derivative - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Aromatic homomonocyclic compound Description This compound belongs to the class of organic compounds known as p-phthalate esters. These are ester derivatives of p-phthalic acids, which are based on a benzene 1,4-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.
Structure 3D Cibles associées (humaines) Mécanismes d'action Certificats (CoA, COO, BSE/TSE et tableau d'analyse) Propriétés chimiques et physiques Point de fusion (°C) 135 - 137 °C Poids moléculaire 254.240 g/mol XLogP3 2.800 Hydrogen Bond Donor Count 2 Hydrogen Bond Acceptor Count 6 Rotatable Bond Count 6 Exact Mass 254.079 Da Monoisotopic Mass 254.079 Da Topological Polar Surface Area 93.100 Ų Heavy Atom Count 18 Formal Charge 0 Complexity 273.000 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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