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· · COA & SDS available for every product · Same-day shipping on in-stock items Dibutyl Fumarate - ≥98%(GC) , CAS No.105-75-9
Synonyms
F0001-2446 | Stafex DBF | WLN: 4OV1U1VO4-T | Staflex DBF | Dibutylester kyseliny fumarove | Di-n-butyl fumarate | EC 203-327-9 | 2-Butenedioic acid, dibutyl ester, (2E)- | CQM31Z1NU9 | (E)-dibutyl butenedioate | Fumaric acid, dibutyl ester | MFCD00065141
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Why this grade ≥98%(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 Synonyms
F0001-2446 | Stafex DBF | WLN: 4OV1U1VO4-T | Staflex DBF | Dibutylester kyseliny fumarove | Di-n-butyl fumarate | EC 203-327-9 | 2-Butenedioic acid, dibutyl ester, (2E)- | CQM31Z1NU9 | (E)-dibutyl butenedioate | Fumaric acid, dibutyl ester | MFCD00065141
Specifications & Purity
≥98%(GC)
Names and Identifiers Pubchem Sid 488195192 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/488195192 Canonical Smiles CCCCOC(=O)C=CC(=O)OCCCC IUPAC Name dibutyl (E)-but-2-enedioate InChIKey JBSLOWBPDRZSMB-BQYQJAHWSA-N INCHI 1S/C12H20O4/c1-3-5-9-15-11(13)7-8-12(14)16-10-6-4-2/h7-8H,3-6,9-10H2,1-2H3/b8-7+ Isomeric SMILES CCCCOC(=O)/C=C/C(=O)OCCCC RTECS LT1225000 Molecular Weight 228.29 Beilstein 2(4)2210 Reaxy-Rn 10662959 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=10662959&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 Lipids and lipid-like molecules Class Fatty Acyls Subclass Fatty acid esters Intermediate Tree Nodes Not available Direct Parent Fatty acid esters Alternative Parents Dicarboxylic acids and derivatives Enoate esters Organic oxides Hydrocarbon derivatives Carbonyl compounds Molecular Framework Aliphatic acyclic compounds Substituents Fatty acid ester - Dicarboxylic acid or derivatives - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Carboxylic acid ester - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound Description This compound belongs to the class of organic compounds known as fatty acid esters. These are carboxylic ester derivatives of a fatty acid. 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(non-human) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Solubility Insoluble in water; Soluble in Chloroform,Acetone Refractive Index 1.45 Flash Point(°F) 142°C(lit.) Flash Point(°C) 142°C(lit.) Boil Point(°C) 285°C(lit.) Melt Point(°C) -18°C(lit.) Molecular Weight 228.280 g/mol XLogP3 2.700 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 4 Rotatable Bond Count 10 Exact Mass 228.136 Da Monoisotopic Mass 228.136 Da Topological Polar Surface Area 52.600 Ų Heavy Atom Count 16 Formal Charge 0 Complexity 209.000 Isotope Atom Count 0 Defined Atom Stereocenter Count 0 Undefined Atom Stereocenter Count 0 Defined Bond Stereocenter Count 1 Undefined Bond Stereocenter Count 0 The total count of all stereochemical bonds 1 Covalently-Bonded Unit Count 1
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