3-Ethyl-2-pentene - ≥98%(GC) , CAS No.816-79-5

CAS: 816-79-5 Cat. No.: E156180 Fórmula: C₇H₁₄ Peso molecular: 98.19 Beilstein Registry Number: 1(4)868 Número EC: 212-438-1

CALIDAD & PUREZA ≥98%(GC)

Synonyms

1,1-Diethyl-1-propene|2-Pentene, 3-ethyl-|3-ETHYL-2-PENTENE|3-ethyl-pent-2-ene|3-Ethylpent-2-ene

Storage

Room temperature

Shipped In

Normal

Descripción general

Product Describtion:

3-Ethyl-2-pentene is a trisubstituted olefin.

Product Application:

3-Ethyl-2-pentene may be used in the preparation of:

(2E,3R)-2-hydroxy-3,4-dimethyl-N-phenylpent-4-enamide;

3-ethyl-1-pentene;

5-ethyl-2,4-dimethyl-4-hepten-3-one.

Especificaciones

Sinónimos

1,1-Diethyl-1-propene | 2-Pentene, 3-ethyl- | 3-ETHYL-2-PENTENE | 3-ethyl-pent-2-ene | 3-Ethylpent-2-ene

Especificaciones y pureza

≥98%(GC)

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Pureza

≥98%(GC)

Nombres e identificadores

Pubchem Sid

504752427

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504752427

Sonrisas canónicas

CCC(=CC)CC

IUPAC Name

3-ethylpent-2-ene

InChIKey

XMYFZAWUNVHVGI-UHFFFAOYSA-N

INCHI

1S/C7H14/c1-4-7(5-2)6-3/h4H,5-6H2,1-3H3

Isómeros SMILES

CCC(=CC)CC

WGK Alemania

3

Peso molecular

98.19

Beilstein

1(4)868

Reaxy-Rn

1731748

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1731748&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Hydrocarbons
    • Clase Unsaturated hydrocarbons
      • Subclass Branched unsaturated hydrocarbons

• Kingdom: Organic compounds
• Superclass: Hydrocarbons
• Clase: Unsaturated hydrocarbons
• Subclass: Branched unsaturated hydrocarbons
• Intermediate Tree Nodes: Not available
• Direct Parent: Branched unsaturated hydrocarbons
• Alternative Parents: Unsaturated aliphatic hydrocarbons Alkenes
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Branched unsaturated hydrocarbon - Unsaturated aliphatic hydrocarbon - Olefin - Alkene - Acyclic olefin - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as branched unsaturated hydrocarbons. These are hydrocarbons that contains one or more unsaturated carbon atoms, and an aliphatic branch.
• 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

• Índice de refracción: 1.4130 to 1.4160
• Punto de inflamación (°F): 35.6 °F
• Punto de inflamación (°C): 2°C
• Punto de ebullición (°C): 96°C
• Peso molecular: 98.190 g/mol
• XLogP3: 3.200
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 2
• Exact Mass: 98.1096 Da
• Monoisotopic Mass: 98.1096 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 54.400
• 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

Preguntas frecuentes

What is the purity of this product, and how is it determined?

This product is supplied at ≥98% purity, determined by gas chromatography (GC). 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 ships under standard ambient conditions. No temperature-controlled packaging is required.

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

The CAS Number is 816-79-5, the molecular formula is C7H14, and the molecular weight is 98.19 g/mol. InChIKey XMYFZAWUNVHVGI-UHFFFAOYSA-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.