エイコサン - GC用標準品、≥99%(GC) , CAS No.112-95-8

CAS: 112-95-8 Cat. No.: E100483 分子式: C₂₀H₄₂ 分子量: 282.55 Beilstein Registry Number: 1700722 EC番号: 204-018-1

グレード＆純度 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

ノーマル

仕様

同義語

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

仕様と純度

GC用標準品、≥99%(GC)

保管条件

Room temperature

入荷

ノーマル

等級

Standard for GC

純度

≥99%(GC)

名前と識別子

パブケム・シド

528769596

カノニカル・スマイル

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

異性体SMILES

CCCCCCCCCCCCCCCCCCCC

WGKドイツ

3

分子量

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
    • 分類 Saturated hydrocarbons
      • Subclass Alkanes

• Kingdom: Organic compounds
• Superclass: Hydrocarbons
• 分類: 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
• 説明: 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

化学的性質と物理的性質

• 溶解度: Insoluble in water; Soluble in Toluene,Benzene
• 屈折率: 1.4425
• 引火点（°F）: >235.4 °F
• 引火点（°C）: >110℃
• 沸点（°C）: 343°C
• 融点（°C）: 36.8°C
• 分子量: 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