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· · COA & SDS available for every product · Same-day shipping on in-stock items Ethyl 6-oxohexanoate - ≥95% , CAS No.27983-42-2
Synonyms
ethyl6-oxohexanoate | DTXSID30457523 | 6-oxohexanoic acid ethyl ester | 6-oxo-hexanoic acid ethyl ester | AM85368 | Hexanoic acid, 6-oxo-, ethyl ester | Ethyl 5-formylpentanoate | MFCD17170722 | FT-0696257 | SCHEMBL1306604 | N10652 | ethyl 6-oxohexanoate
Storage
Store at -20°C,Argon charged
Shipped In
Ice chest + Ice pads
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Why this grade ≥95% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Store at -20°C,Argon charged 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.
Specifications Synonyms
ethyl6-oxohexanoate | DTXSID30457523 | 6-oxohexanoic acid ethyl ester | 6-oxo-hexanoic acid ethyl ester | AM85368 | Hexanoic acid, 6-oxo-, ethyl ester | Ethyl 5-formylpentanoate | MFCD17170722 | FT-0696257 | SCHEMBL1306604 | N10652 | ethyl 6-oxohexanoate
Specifications & Purity
≥95%
Storage
Store at -20°C, Argon charged
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 CCOC(=O)CCCCC=O IUPAC Name ethyl 6-oxohexanoate InChIKey UWNBKRSENSOXKX-UHFFFAOYSA-N INCHI 1S/C8H14O3/c1-2-11-8(10)6-4-3-5-7-9/h7H,2-6H2,1H3 Isomeric SMILES CCOC(=O)CCCCC=O Molecular Weight 158.19 Reaxy-Rn 1759848 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1759848&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 Medium-chain aldehydes Alpha-hydrogen aldehydes Carboxylic acid esters Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Molecular Framework Aliphatic acyclic compounds Substituents Medium-chain aldehyde - Fatty acid ester - Alpha-hydrogen aldehyde - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aldehyde - 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 Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Molecular Weight 158.190 g/mol XLogP3 0.600 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 3 Rotatable Bond Count 7 Exact Mass 158.094 Da Monoisotopic Mass 158.094 Da Topological Polar Surface Area 43.400 Ų Heavy Atom Count 11 Formal Charge 0 Complexity 121.000 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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