1-Eicosene [Standard Material for GC] - ≥99.5%(GC) , CAS No.3452-07-1

CAS: 3452-07-1 Cat. No.: E156171 Peso molecular: 280.54 Beilstein Registry Number: 1(4)934 Número EC: 222-374-6

GRADE & PURITY ≥99.5%(GC)

Synonyms

AS-75616 | J-019632 | NEODENE C 20 | 1-EICOSENE | Methylene nonadecane | DTXSID1029257 | LMFA11000314 | NSC 77138 | Arachydene | DTXCID609257 | UNII-6BHH7ZD637 | EINECS 300-202-1 | 1-Eicosene, tech grade | Eicos-1-ene | Alkenes, C20-24 alpha- | Q2419305 |

Storage

Room temperature

Shipped In

Normal

Specifications

Sinónimos

AS-75616 | J-019632 | NEODENE C 20 | 1-EICOSENE | Methylene nonadecane | DTXSID1029257 | LMFA11000314 | NSC 77138 | Arachydene | DTXCID609257 | UNII-6BHH7ZD637 | EINECS 300-202-1 | 1-Eicosene, tech grade | Eicos-1-ene | Alkenes, C20-24 alpha- | Q2419305 |

Especificaciones y pureza

≥99.5%(GC)

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Pureza

≥99.5%(GC)

Nombres e identificadores

• Sonrisas canónicas: CCCCCCCCCCCCCCCCCCC=C
• IUPAC Name: icos-1-ene
• InChIKey: VAMFXQBUQXONLZ-UHFFFAOYSA-N
• INCHI: 1S/C20H40/c1-3-5-7-9-11-13-15-17-19-20-18-16-14-12-10-8-6-4-2/h3H,1,4-20H2,2H3
• Isómeros SMILES: CCCCCCCCCCCCCCCCCCC=C
• Peso molecular: 280.54
• Beilstein: 1(4)934
• Reaxy-Rn: 1768357
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1768357&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: 1.45
• Punto de ebullición (°C): 151°C/1.5mmHg(lit.)
• Punto de fusión (°C): 29 °C
• Peso molecular: 280.500 g/mol
• XLogP3: 11.100
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 17
• Exact Mass: 280.313 Da
• Monoisotopic Mass: 280.313 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 20
• Formal Charge: 0
• Complexity: 171.000
• 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

Referencias

1. Weiwei Ge, Huihui Pai, Jiale Zhang, Chuanbo Zhang, Wenyu Lu.  (2025)  Construction of isopentenol utilization pathway and artificial multifunctional enzyme for miltiradiene synthesis in Saccharomyces cerevisiae.  BIORESOURCE TECHNOLOGY,      [PMID:39809383] [10.1016/j.biortech.2025.132065]