5,6-Dihydrodicyclopentadiene - ≥95%(GC) , CAS No.4488-57-7

CAS: 4488-57-7 Cat. No.: D155269 Peso molecular: 134.22 Número EC: 224-778-8

GRADE & PURITY ≥95%(GC)

Synonyms

5,6-Dihydrodicyclopentadiene | D2001 | DHDCPD | Tricyclo(5.2.1.0(2,6))dec-4-ene | Tricyclo[5.2.1.02,6]decan-3-ene | 3a,4,7,7a-Tetrahydro-4,7-methanoindan | AKOS025295338 | EINECS 224-778-8 | tricyclo[5.2.1.02,6]dec-3-ene | Laninamivir octanoic acid ester

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

Sinónimos

5, 6-Dihydrodicyclopentadiene | D2001 | DHDCPD | Tricyclo(5.2.1.0(2, 6))dec-4-ene | Tricyclo[5.2.1.02, 6]decan-3-ene | 3a, 4, 7, 7a-Tetrahydro-4, 7-methanoindan | AKOS025295338 | EINECS 224-778-8 | tricyclo[5.2.1.02, 6]dec-3-ene | Laninamivir octanoic acid ester

Especificaciones y pureza

≥95%(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

≥95%(GC)

Nombres e identificadores

• Sonrisas canónicas: C1CC2CC1C3C2C=CC3
• IUPAC Name: tricyclo[5.2.1.02,6]dec-3-ene
• InChIKey: HANKSFAYJLDDKP-UHFFFAOYSA-N
• INCHI: 1S/C10H14/c1-2-9-7-4-5-8(6-7)10(9)3-1/h1-2,7-10H,3-6H2
• Isómeros SMILES: C1CC2CC1C3C2C=CC3
• Peso molecular: 134.22
• Reaxy-Rn: 1854387
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1854387&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Lipids and lipid-like molecules
    • Clase Prenol lipids
      • Subclass Monoterpenoids

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Clase: Prenol lipids
• Subclass: Monoterpenoids
• Intermediate Tree Nodes: Not available
• Direct Parent: Monoterpenoids
• Alternative Parents: Polycyclic hydrocarbons Cyclic olefins Unsaturated aliphatic hydrocarbons
• Molecular Framework: Aliphatic homopolycyclic compounds
• Substituents: Norbornane monoterpenoid - Monoterpenoid - Polycyclic hydrocarbon - Cyclic olefin - Unsaturated aliphatic hydrocarbon - Unsaturated hydrocarbon - Olefin - Hydrocarbon - Aliphatic homopolycyclic compound
• Descripción: This compound belongs to the class of organic compounds known as monoterpenoids. These are compounds containing a chain of two isoprene units.
• 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

• Punto de ebullición (°C): 180°C(lit.)
• Punto de fusión (°C): 49 °C
• Peso molecular: 134.220 g/mol
• XLogP3: 3.100
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 134.11 Da
• Monoisotopic Mass: 134.11 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 180.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 4
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1