trans-3-Octene - ≥98%(GC) , CAS No.14919-01-8

CAS: 14919-01-8 Cat. No.: T161817 Fórmula: C₈H₁₆ Peso molecular: 112.22 Número CE: 238-990-3

GRADE & PURITY ≥98%(GC)

Synonyms

NSC95418 | NSC-95418 | EC 246-920-8 | EINECS 209-779-3 | AKOS015916273 | J-006449 | 3-Octene, (E)- | (3E)-3-Octene | Q27160872 | 3-octene, (3E)- | Octene (all isomers) | (E)-3-Octene | (E)-Oct-3-ene | trans-3-Octene | (E)-3-C8H16 | NSC 95418 | O0134 | J-0

Storage

Room temperature,Argon charged

Shipped In

Normal

Specifications

Sinónimos

NSC95418 | NSC-95418 | EC 246-920-8 | EINECS 209-779-3 | AKOS015916273 | J-006449 | 3-Octene, (E)- | (3E)-3-Octene | Q27160872 | 3-octene, (3E)- | Octene (all isomers) | (E)-3-Octene | (E)-Oct-3-ene | trans-3-Octene | (E)-3-C8H16 | NSC 95418 | O0134 | J-0

Especificações e pureza

≥98%(GC)

Condições de armazenamento de armazenamento

Room temperature,Argon charged

Enviado em

Normal

Pureza

≥98%(GC)

Nomes e identificadores

Pubchem Sid

504759658

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504759658

Sorrisos canónicos

CCCCC=CCC

IUPAC Name

(E)-oct-3-ene

InChIKey

YCTDZYMMFQCTEO-FNORWQNLSA-N

INCHI

1S/C8H16/c1-3-5-7-8-6-4-2/h5,7H,3-4,6,8H2,1-2H3/b7-5+

SMILES isoméricas

CCCC/C=C/CC

WGK Alemanha

3

Peso molecular

112.22

Reaxy-Rn

1719384

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1719384&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Hydrocarbons
• Classe: 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
• Descrição: 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: 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

Propriedades químicas e físicas

• Sensibilidade: Air sensitive
• Índice de refração: 1.413
• Ponto de inflamação (°F): 57.2 °F
• Ponto de inflamação (°C): 14°C
• Ponto de ebulição (°C): 121-122 °C
• Peso molecular: 112.210 g/mol
• XLogP3: 3.600
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 4
• 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: 53.100
• 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