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2-Hexene - 85%，cis + trans, high purity , CAS No.592-43-8
Basic Description
Synonyms
Hexene, isomer | 2-Hexene, (cis and trans) | Hexene, isomers | NSC 74123 | EINECS 246-768-2 | (2E)-2-Hexene # | 2-Hexene, (E)- | 2-Hexene (cis+trans), technical grade, 85% | EINECS 209-755-2 | RYPKRALMXUUNKS-HWKANZROSA-N | CHEBI:137755 | trans-2-Hexene |
Specifications & Purity
≥85%, mixture of cis and trans isomers
Shipped In
Normal
Product Description
The product is a mixture of cis- and trans-2-hexene. 1-hexene undergoes isomerization on 6080-mesh ZSM (Zeolite Socony Mobil)-5 zeolite to form cis- and trans-2-hexene as the predominant products.
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
Hydrocarbons
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.
Names and Identifiers
Pubchem Sid
488190887
Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/488190887
IUPAC Name
(E)-hex-2-ene
INCHI
InChI=1S/C6H12/c1-3-5-6-4-2/h3,5H,4,6H2,1-2H3/b5-3+
InChIKey
RYPKRALMXUUNKS-HWKANZROSA-N
Smiles
CCCC=CC
Isomeric SMILES
CCC/C=C/C
WGK Germany
3
Molecular Weight
84.16
Beilstein
969179
Reaxy-Rn
969179
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=969179&ln=
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Refractive Index
1.395 (lit.)
Flash Point(°F)
-4 °F
Flash Point(°C)
-20 °C
Boil Point(°C)
67-69 °C (lit.)
Molecular Weight
84.160 g/mol
XLogP3
2.600
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
0
Rotatable Bond Count
2
Exact Mass
84.0939 Da
Monoisotopic Mass
84.0939 Da
Topological Polar Surface Area
0.000 Ų
Heavy Atom Count
6
Formal Charge
0
Complexity
35.300
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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