2-Nonyne - ≥95%(GC) , CAS No.19447-29-1

CAS: 19447-29-1 Cat. No.: N159652 Formule: C₉H₁₆ Poids moléculaire: 124.23 Numéro CE: 678-271-5

GRADE & PURITY ≥95%(GC)

Synonyms

2-Nonyne|19447-29-1|non-2-yne|2-C9H16|DTXSID10173077|LXKRETAGISZJAD-UHFFFAOYSA-N|MFCD00039986|AKOS015841157|FT-0637852

Storage

Room temperature

Shipped In

Normal

Specifications

Synonymes

2-Nonyne | 19447-29-1 | non-2-yne | 2-C9H16 | DTXSID10173077 | LXKRETAGISZJAD-UHFFFAOYSA-N | MFCD00039986 | AKOS015841157 | FT-0637852

Spécifications et pureté

≥95%(GC)

Conditions de stockage de stockage

Room temperature

Expédié en

Normal

Pureté

≥95%(GC)

Noms et identifiants

Sourires canoniques

CCCCCCC#CC

IUPAC Name

non-2-yne

InChIKey

LXKRETAGISZJAD-UHFFFAOYSA-N

INCHI

1S/C9H16/c1-3-5-7-9-8-6-4-2/h3,5,7-9H2,1-2H3

Isomères SMILES

CCCCCCC#CC

Poids moléculaire

124.23

Reaxy-Rn

1736593

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1736593&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Hydrocarbons
    • Classe Unsaturated hydrocarbons
      • Subclass Acetylenes
        • Level5 Acyclic acetylenes
          • Level6 Alkynes
            • Level7 Terminal alkynes

• Kingdom: Organic compounds
• Superclass: Hydrocarbons
• Classe: Unsaturated hydrocarbons
• Subclass: Acetylenes
• Intermediate Tree Nodes: Acyclic acetylenes - Alkynes
• Direct Parent: Terminal alkynes
• Alternative Parents: Unsaturated aliphatic hydrocarbons
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Monosubstituted alkyne - Unsaturated aliphatic hydrocarbon - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as terminal alkynes. These are alkynes featuring a carbon substituent on one acetylenic carbon, and a hydrogen on the other carbon.
• 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

Propriétés chimiques et physiques

• Point d'éclair (°F): 35°C(lit.)
• Point d'éclair (°C): 35°C(lit.)
• Point d'ébullition (°C): 156°C
• Poids moléculaire: 124.220 g/mol
• XLogP3: 4.000
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 4
• Exact Mass: 124.125 Da
• Monoisotopic Mass: 124.125 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 99.700
• 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