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· · COA & SDS available for every product · Same-day shipping on in-stock items 1-Octene - analytical standard, ≥99.5%(GC) , CAS No.111-66-0
GRADE & PURITY Analytical standard ? Analytical standard — certified-purity material for quantitative calibration. Use to prepare calibration standards and validate analytical methods. ≥99.5%(GC) Synonyms
1-OCTENE|Oct-1-ene|111-66-0|Caprylene|n-1-Octene|1-Octylene|Octylene|alpha-Octene|OCTENE-1|1-Caprylene|Octene|alpha-Octylene|.alpha.-Octene|.alpha.-Octylene|NSC 8457|Neodene 8|MFCD00009548|E5VK21B9RC|DTXSID6025804|CHEBI:46708|NSC-8457|1-C8H16|1-Octene, 98
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Why this grade analytical standard, ≥99.5%(GC) Analytical standard for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Room temperature Ships FedEx DG Service 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 81 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Specifications Synonyms
1-OCTENE | Oct-1-ene | 111-66-0 | Caprylene | n-1-Octene | 1-Octylene | Octylene | alpha-Octene | OCTENE-1 | 1-Caprylene | Octene | alpha-Octylene | .alpha.-Octene | .alpha.-Octylene | NSC 8457 | Neodene 8 | MFCD00009548 | E5VK21B9RC | DTXSID6025804 | CHEBI:46708 | NSC-8457 | 1-C8H16 | 1-Octene, 98
Specifications & Purity
analytical standard, ≥99.5%(GC)
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Names and Identifiers Canonical Smiles
CCCCCCC=C
InChIKey
KWKAKUADMBZCLK-UHFFFAOYSA-N
INCHI
1S/C8H16/c1-3-5-7-8-6-4-2/h3H,1,4-8H2,2H3
Isomeric SMILES
CCCCCCC=C
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1734497&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 Hydrocarbons Class Unsaturated hydrocarbons Subclass Unsaturated aliphatic hydrocarbons Intermediate Tree Nodes Not available Direct Parent Unsaturated aliphatic hydrocarbons Alternative Parents Alkenes Molecular Framework Aliphatic acyclic compounds Substituents Unsaturated aliphatic hydrocarbon - Olefin - Alkene - Acyclic olefin - Aliphatic acyclic compound Description This compound belongs to the class of organic compounds known as unsaturated aliphatic hydrocarbons. These are aliphatic Hydrocarbons that contains one or more unsaturated carbon atoms. These compounds contain one or more double or triple bonds. External Descriptors octene 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 Solubility Insoluble in water, soluble in most organic solvents such as ethanol, ether and acetone. Sensitivity Heat sensitive Refractive Index 1.408-1.41 Flash Point(°F) 50 °F Flash Point(°C) 13℃ Boil Point(°C) 121-123°C Melt Point(°C) -102°C Molecular Weight 112.210 g/mol XLogP3 4.600 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 0 Rotatable Bond Count 5 Exact Mass 112.125 Da Monoisotopic Mass 112.125 Da Topological Polar Surface Area 0.000 Ų Heavy Atom Count 8 Formal Charge 0 Complexity 46.000 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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