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· · COA & SDS available for every product · Same-day shipping on in-stock items Methyl 2,4-dichloroasterrate - ≥95%(LC/MS-UV) , CAS No.398118-62-2
Synonyms
benzoic acid, 3,5-dichloro-2-hydroxy-6-[4-hydroxy-2-methoxy-6-(methoxycarbonyl)phenoxy]-4-methyl-, methyl ester | DTXSID601346316 | Methyl dichloroasterrate | Methyl 2,4-dichloroasterrate, >=95% (LC/MS-UV) | Geodinhydrat-methylester | InChI=1/C18H16Cl2O8/
Shipped In
Ice chest + Ice pads
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Why this grade ≥95%(LC/MS-UV) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Store at -20°C Ships Ice chest + Ice pads 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.
Overview Description
Natural product derived from fungal source.
Specifications Synonyms
benzoic acid, 3, 5-dichloro-2-hydroxy-6-[4-hydroxy-2-methoxy-6-(methoxycarbonyl)phenoxy]-4-methyl-, methyl ester | DTXSID601346316 | Methyl dichloroasterrate | Methyl 2, 4-dichloroasterrate, >=95% (LC/MS-UV) | Geodinhydrat-methylester | InChI=1/C18H16Cl2O8/
Specifications & Purity
≥95%(LC/MS-UV)
Shipped In
Ice chest + Ice pads
This product requires cold chain shipping. Ground and other economy services are not available.
Names and Identifiers Canonical Smiles CC1=C(C(=C(C(=C1Cl)OC2=C(C=C(C=C2OC)O)C(=O)OC)C(=O)OC)O)Cl IUPAC Name methyl 3,5-dichloro-2-hydroxy-6-(4-hydroxy-2-methoxy-6-methoxycarbonylphenoxy)-4-methylbenzoate InChIKey UWTOESDPWKUNBD-UHFFFAOYSA-N INCHI 1S/C18H16Cl2O8/c1-7-12(19)14(22)11(18(24)27-4)16(13(7)20)28-15-9(17(23)26-3)5-8(21)6-10(15)25-2/h5-6,21-22H,1-4H3 Isomeric SMILES CC1=C(C(=C(C(=C1Cl)OC2=C(C=C(C=C2OC)O)C(=O)OC)C(=O)OC)O)Cl Molecular Weight 431.22 Reaxy-Rn 2681712 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2681712&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 Class Benzene and substituted derivatives Subclass Diphenylethers Intermediate Tree Nodes Not available Direct Parent Diphenylethers Alternative Parents o-Hydroxybenzoic acid esters m-Hydroxybenzoic acid esters Diarylethers M-methoxybenzoic acids and derivatives 3-halobenzoic acids and derivatives Salicylic acid and derivatives Methoxyphenols Anisoles Benzoyl derivatives Dichlorobenzenes Phenoxy compounds Meta cresols Methoxybenzenes P-chlorophenols O-chlorophenols Alkyl aryl ethers 1-hydroxy-2-unsubstituted benzenoids Toluenes Aryl chlorides Dicarboxylic acids and derivatives Vinylogous acids Methyl esters Hydrocarbon derivatives Organic oxides Organochlorides Molecular Framework Aromatic homomonocyclic compounds Substituents Diphenylether - M-hydroxybenzoic acid ester - O-hydroxybenzoic acid ester - Diaryl ether - M-methoxybenzoic acid or derivatives - Benzoate ester - Methoxyphenol - Salicylic acid or derivatives - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoic acid or derivatives - Anisole - Phenoxy compound - Benzoyl - 1,3-dichlorobenzene - 4-halophenol - 2-halophenol - M-cresol - 2-chlorophenol - 4-chlorophenol - Phenol ether - Methoxybenzene - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Halobenzene - Toluene - Chlorobenzene - Phenol - Aryl halide - Aryl chloride - Dicarboxylic acid or derivatives - Methyl ester - Vinylogous acid - Carboxylic acid ester - Carboxylic acid derivative - Ether - Organochloride - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Organohalogen compound - Aromatic homomonocyclic compound Description This compound belongs to the class of organic compounds known as diphenylethers. These are aromatic compounds containing two benzene rings linked to each other through an ether group. 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.
3D Structure Associated Targets(Human) Associated Targets(non-human) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Solubility DMSO: 1mg/mL Flash Point(°F) Not applicable Flash Point(°C) Not applicable Molecular Weight 431.200 g/mol XLogP3 4.600 Hydrogen Bond Donor Count 2 Hydrogen Bond Acceptor Count 8 Rotatable Bond Count 7 Exact Mass 430.022 Da Monoisotopic Mass 430.022 Da Topological Polar Surface Area 112.000 Ų Heavy Atom Count 28 Formal Charge 0 Complexity 562.000 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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