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· · COA & SDS available for every product · Same-day shipping on in-stock items Dimethyl 2-(2-nitrophenyl)malonate - ≥95% , CAS No.26465-37-2
Synonyms
NCGC00161165-02 | FT-0679934 | SMR000126199 | F79950 | NCGC00161165-01 | 1,3-dimethyl 2-(2-nitrophenyl)propanedioate | 12T-0006 | A877220 | Propanedioic acid, 2-(2-nitrophenyl)-, 1,3-dimethyl ester | HMS2315L07 | DTXSID90409341 | AKOS005069636 | BBA46537
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Why this grade ≥95% 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
NCGC00161165-02 | FT-0679934 | SMR000126199 | F79950 | NCGC00161165-01 | 1, 3-dimethyl 2-(2-nitrophenyl)propanedioate | 12T-0006 | A877220 | Propanedioic acid, 2-(2-nitrophenyl)-, 1, 3-dimethyl ester | HMS2315L07 | DTXSID90409341 | AKOS005069636 | BBA46537
Specifications & Purity
≥95%
Names and Identifiers Pubchem Sid 488195143 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/488195143 Canonical Smiles COC(=O)C(C1=CC=CC=C1[N+](=O)[O-])C(=O)OC IUPAC Name dimethyl 2-(2-nitrophenyl)propanedioate InChIKey YDGNTNNTVUTSQE-UHFFFAOYSA-N INCHI 1S/C11H11NO6/c1-17-10(13)9(11(14)18-2)7-5-3-4-6-8(7)12(15)16/h3-6,9H,1-2H3 Isomeric SMILES COC(=O)C(C1=CC=CC=C1[N+](=O)[O-])C(=O)OC Molecular Weight 253.21 Reaxy-Rn 2145242 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2145242&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 Nitrobenzenes Intermediate Tree Nodes Not available Direct Parent Nitrobenzenes Alternative Parents Nitroaromatic compounds Dicarboxylic acids and derivatives 1,3-dicarbonyl compounds Methyl esters Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Organopnictogen compounds Organonitrogen compounds Organic salts Organic oxides Hydrocarbon derivatives Organic cations Molecular Framework Aromatic homomonocyclic compounds Substituents Nitrobenzene - Nitroaromatic compound - Dicarboxylic acid or derivatives - 1,3-dicarbonyl compound - Methyl ester - Carboxylic acid ester - C-nitro compound - Organic nitro compound - Carboxylic acid derivative - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Carbonyl group - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organic salt - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic cation - Aromatic homomonocyclic compound Description This compound belongs to the class of organic compounds known as nitrobenzenes. These are compounds containing a nitrobenzene moiety, which consists of a benzene ring with a carbon bearing a nitro 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) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Melt Point(°C) 48-50° Molecular Weight 253.210 g/mol XLogP3 1.700 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 6 Rotatable Bond Count 5 Exact Mass 253.059 Da Monoisotopic Mass 253.059 Da Topological Polar Surface Area 98.400 Ų Heavy Atom Count 18 Formal Charge 0 Complexity 321.000 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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