2-Hexene - ≥97%,mixture of cis and trans , CAS No.592-43-8

CAS: 592-43-8 Cat. No.: H1526994 Fórmula: C₆H₁₂ Peso molecular: 84.16 Beilstein Registry Number: 969179 Número EC: 209-755-2

GRADE & PURITY ≥97%,mixture of cis and trans

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) | EINECS 209-755-2 | RYPKRALMXUUNKS-HWKANZROSA-N | CHEBI:137755 | trans-2-Hexene

Storage

Room temperature

Shipped In

FedEx DG Service

Descripción general

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.

Specifications

Sinónimos

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) | EINECS 209-755-2 | RYPKRALMXUUNKS-HWKANZROSA-N | CHEBI:137755 | trans-2-Hexene

Especificaciones y pureza

≥97%,mixture of cis and trans

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

FedEx DG Service

Pureza

≥97%,mixture of cis and trans

Nombres e identificadores

• Sonrisas canónicas: CCCC=CC
• IUPAC Name: (E)-hex-2-ene
• InChIKey: RYPKRALMXUUNKS-HWKANZROSA-N
• INCHI: 1S/C6H12/c1-3-5-6-4-2/h3,5H,4,6H2,1-2H3/b5-3+
• Isómeros SMILES: CCC/C=C/C
• WGK Alemania: 3
• Número NSC: UN 3295
• Grupo de embalaje: II
• Peso molecular: 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=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Hydrocarbons
    • Clase Unsaturated hydrocarbons
      • Subclass Unsaturated aliphatic hydrocarbons

• Kingdom: Organic compounds
• Superclass: Hydrocarbons
• Clase: 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
• Descripción: 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.

DOI: 10.1186/s13321-016-0174-y

Propiedades químicas y físicas

• Índice de refracción: 1.395 (lit.)
• Punto de inflamación (°F): -4 °F
• Punto de inflamación (°C): -20 °C
• Punto de ebullición (°C): 67-69 °C (lit.)
• Peso molecular: 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

Referencias

1. Yuqing Wang, Miao Jiang, Na Liu, Tian Tian, Changdao Li, Zhao Sun, Gewen Yu, Yanming Wang, Wenxiu He, Jian Ding, Li Yan, Yunjie Ding.  (2025)  Constructing nitrogen-doped porous organic polymer- supported single-atom cobalt catalysts for highly efficient hydroformylation of internal olefins.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2025.166057]

Preguntas frecuentes

What is the isomeric composition of this product?

This product is supplied at ≥97%, mixture of cis and trans. Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature.

How is this product shipped?

This product is classified as dangerous goods and ships via FedEx DG Service. Ground and other economy services are not available, and delivery to some destinations or address types may be restricted.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 592-43-8, the molecular formula is C6H12, and the molecular weight is 84.16 g/mol. InChIKey RYPKRALMXUUNKS-HWKANZROSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.