1,3,5-Undecatriene (mixture of isomers) - ≥75%(GC) , CAS No.16356-11-9

CAS: 16356-11-9 Cat. No.: U162904 Peso molecular: 150.27 Número EC: 240-416-1 PubChem CID: 5367412

GRADE & PURITY ≥75%(GC)

Synonyms

(3E,5E)-1,3,5-Undecatriene | Tox21_303704 | 1,3,5-Undecatriene, (3E,5E)- | Q27277175 | 1-(E,E)-3,5-Undecatriene | U0062 | FEMA No. 3795 | DTXSID9047546 | NCGC00357023-01 | 4,5-Dihydroxy-m-benzenedisulfonic acid disodium salt | 465EKH3OG1 | E,E)-1,3,5-UNDE

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

Sinónimos

(3E, 5E)-1, 3, 5-Undecatriene | Tox21_303704 | 1, 3, 5-Undecatriene, (3E, 5E)- | Q27277175 | 1-(E, E)-3, 5-Undecatriene | U0062 | FEMA No. 3795 | DTXSID9047546 | NCGC00357023-01 | 4, 5-Dihydroxy-m-benzenedisulfonic acid disodium salt | 465EKH3OG1 | E, E)-1, 3, 5-UNDE

Especificaciones y pureza

≥75%(GC)

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C

Enviado en

Wet ice

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Pureza

≥75%(GC)

Nombres e identificadores

• Sonrisas canónicas: CCCCCC=CC=CC=C
• IUPAC Name: (3E,5E)-undeca-1,3,5-triene
• InChIKey: JQQDKNVOSLONRS-JEGFTUTRSA-N
• INCHI: 1S/C11H18/c1-3-5-7-9-11-10-8-6-4-2/h3,5,7,9,11H,1,4,6,8,10H2,2H3/b7-5+,11-9+
• Isómeros SMILES: CCCCC/C=C/C=C/C=C
• RTECS: YQ2833000
• PubChem CID: 5367412
• Peso molecular: 150.27
• Reaxy-Rn: 1840900

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Hydrocarbons
    • Clase Unsaturated hydrocarbons
      • Subclass Olefins
        • Level5 Acyclic olefins
          • Level6 Alkatrienes

• Kingdom: Organic compounds
• Superclass: Hydrocarbons
• Clase: Unsaturated hydrocarbons
• Subclass: Olefins
• Intermediate Tree Nodes: Acyclic olefins
• Direct Parent: Alkatrienes
• Alternative Parents: Unsaturated aliphatic hydrocarbons
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Alkatriene - Unsaturated aliphatic hydrocarbon - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as alkatrienes. These are acyclic hydrocarbons that contain exactly three carbon-to-carbon double bonds.
• 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.

DOI: 10.1186/s13321-016-0174-y

Propiedades químicas y físicas

• Sensibilidad: Heat Sensitive
• Índice de refracción: 1.5
• Punto de inflamación (°F): 65°C(lit.)
• Punto de inflamación (°C): 65°C(lit.)
• Punto de ebullición (°C): 88 °C/1 mmHg
• Peso molecular: 150.260 g/mol
• XLogP3: 4.800
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 6
• Exact Mass: 150.141 Da
• Monoisotopic Mass: 150.141 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 129.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 2
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 2
• Covalently-Bonded Unit Count: 1