Eicosane - Standard for GC, ≥99%(GC) , CAS No.112-95-8

CAS: 112-95-8 Cat. No.: E100483 Formule: C₂₀H₄₂ Poids moléculaire: 282.55 Beilstein Registry Number: 1700722 Numéro CE: 204-018-1

QUALITÉ & PURETÉ Standard for GC, ≥99%(GC)

Synonyms

PARAFOL 20Z|Nonadecane, methyl-|EICOSANE|n-Eicosane|N-EICOSANE-D42|n-icosane|DIDECYL|Eicosane; MPCM 37; NSC 62789; Parafol 20Z; n-Eicosane|Icosane|EICOSANE [INCI]|octyldodecane

Storage

Room temperature

Shipped In

Normal

Spécifications

Synonymes

PARAFOL 20Z | Nonadecane, methyl- | EICOSANE | n-Eicosane | N-EICOSANE-D42 | n-icosane | DIDECYL | Eicosane; MPCM 37; NSC 62789; Parafol 20Z; n-Eicosane | Icosane | EICOSANE [INCI] | octyldodecane

Spécifications et pureté

Standard for GC, ≥99%(GC)

Conditions de stockage de stockage

Room temperature

Expédié en

Normal

Grade

Standard for GC

Pureté

≥99%(GC)

Noms et identifiants

Pubchem Sid

528769596

Sourires canoniques

CCCCCCCCCCCCCCCCCCCC

IUPAC Name

icosane

InChIKey

CBFCDTFDPHXCNY-UHFFFAOYSA-N

INCHI

1S/C20H42/c1-3-5-7-9-11-13-15-17-19-20-18-16-14-12-10-8-6-4-2/h3-20H2,1-2H3

Isomères SMILES

CCCCCCCCCCCCCCCCCCCC

WGK Allemagne

3

Poids moléculaire

282.55

Beilstein

1700722

Reaxy-Rn

1700722

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1700722&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Hydrocarbons
    • Classe Saturated hydrocarbons
      • Subclass Alkanes

• Kingdom: Organic compounds
• Superclass: Hydrocarbons
• Classe: Saturated hydrocarbons
• Subclass: Alkanes
• Intermediate Tree Nodes: Not available
• Direct Parent: Alkanes
• Alternative Parents: Not available
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Acyclic alkane - Alkane - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as alkanes. These are acyclic branched or unbranched hydrocarbons having the general formula CnH2n+2 , and therefore consisting entirely of hydrogen atoms and saturated carbon atoms.
• External Descriptors: Hydrocarbons

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

• Solubilité: Insoluble in water; Soluble in Toluene,Benzene
• Indice de réfraction: 1.4425
• Point d'éclair (°F): >235.4 °F
• Point d'éclair (°C): >110℃
• Point d'ébullition (°C): 343°C
• Point de fusion (°C): 36.8°C
• Poids moléculaire: 282.500 g/mol
• XLogP3: 10.400
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 17
• Exact Mass: 282.329 Da
• Monoisotopic Mass: 282.329 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 20
• Formal Charge: 0
• Complexity: 132.000
• 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