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· · COA & SDS available for every product · Same-day shipping on in-stock items Dimethyl 2-(5-chloro-3-nitropyridin-2-yl)malonate - ≥98% , CAS No.1261956-26-6
Synonyms
dimethyl 2-(5-chloro-3-nitropyridin-2-yl)propanedioate | DIMETHYL 2-(5-CHLORO-3-NITROPYRIDIN-2-YL)MALONATE | D75075 | AKOS015849005 | DTXSID80682469 | 1261956-26-6 | Dimethyl2-(5-chloro-3-nitropyridin-2-yl)malonate | MFCD18311907 | A889542 | Propanedioic
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Why this grade ≥98% 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 Synonyms
dimethyl 2-(5-chloro-3-nitropyridin-2-yl)propanedioate | DIMETHYL 2-(5-CHLORO-3-NITROPYRIDIN-2-YL)MALONATE | D75075 | AKOS015849005 | DTXSID80682469 | 1261956-26-6 | Dimethyl2-(5-chloro-3-nitropyridin-2-yl)malonate | MFCD18311907 | A889542 | Propanedioic
Specifications & Purity
≥98%
Names and Identifiers Canonical Smiles COC(=O)C(C1=C(C=C(C=N1)Cl)[N+](=O)[O-])C(=O)OC IUPAC Name dimethyl 2-(5-chloro-3-nitropyridin-2-yl)propanedioate InChIKey UVSRKEGGVVTQFK-UHFFFAOYSA-N INCHI 1S/C10H9ClN2O6/c1-18-9(14)7(10(15)19-2)8-6(13(16)17)3-5(11)4-12-8/h3-4,7H,1-2H3 Isomeric SMILES COC(=O)C(C1=C(C=C(C=N1)Cl)[N+](=O)[O-])C(=O)OC PubChem CID 53217429 Molecular Weight 288.6
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 Organic 1,3-dipolar compounds Class Allyl-type 1,3-dipolar organic compounds Subclass Organic nitro compounds Intermediate Tree Nodes C-nitro compounds Direct Parent Nitroaromatic compounds Alternative Parents Pyridines and derivatives 1,3-dicarbonyl compounds Aryl chlorides Dicarboxylic acids and derivatives Heteroaromatic compounds Methyl esters Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Organic zwitterions Hydrocarbon derivatives Organochlorides Organonitrogen compounds Organic oxides Organopnictogen compounds Organic salts Molecular Framework Aromatic heteromonocyclic compounds Substituents Nitroaromatic compound - Aryl chloride - Aryl halide - Dicarboxylic acid or derivatives - Pyridine - 1,3-dicarbonyl compound - Heteroaromatic compound - Methyl ester - Carboxylic acid ester - Azacycle - Organoheterocyclic compound - Propargyl-type 1,3-dipolar organic compound - Organic oxoazanium - Carboxylic acid derivative - Organic nitrogen compound - Carbonyl group - Organooxygen compound - Organonitrogen compound - Organochloride - Organic zwitterion - Organohalogen compound - Organic salt - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic heteromonocyclic compound Description This compound belongs to the class of organic compounds known as nitroaromatic compounds. These are c-nitro compounds where the nitro group is C-substituted with an aromatic 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 Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Molecular Weight 288.640 g/mol XLogP3 1.300 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 7 Rotatable Bond Count 5 Exact Mass 288.015 Da Monoisotopic Mass 288.015 Da Topological Polar Surface Area 111.000 Ų Heavy Atom Count 19 Formal Charge 0 Complexity 356.000 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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