Hexacosane - analytical standard, ≥99.5%(GC) , CAS No.630-01-3

CAS: 630-01-3 Cat. No.: H105441 Fórmula: C₂₆H₅₄ Peso molecular: 366.71 Beilstein Registry Number: 1705609 Número EC: 211-124-1

CALIDAD & PUREZA Analytical standard, ≥99.5%(GC)

Synonyms

HEXACOSANE|Trans-4-hydroxyl-lprolinemethyl esterhydrochloride|HEXACOSANE, N-|n-Hexacosane|Hexacosane; NSC 122457; n-Hexacosane|Pentacosane, methyl-

Storage

Room temperature

Shipped In

Normal

Especificaciones

Sinónimos

HEXACOSANE | Trans-4-hydroxyl-lprolinemethyl esterhydrochloride | HEXACOSANE, N- | n-Hexacosane | Hexacosane; NSC 122457; n-Hexacosane | Pentacosane, methyl-

Especificaciones y pureza

analytical standard, ≥99.5%(GC)

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Grado

Patrón analítico

Pureza

≥99.5%(GC)

Nombres e identificadores

Pubchem Sid

528769595

Sonrisas canónicas

CCCCCCCCCCCCCCCCCCCCCCCCCC

IUPAC Name

hexacosane

InChIKey

HMSWAIKSFDFLKN-UHFFFAOYSA-N

INCHI

1S/C26H54/c1-3-5-7-9-11-13-15-17-19-21-23-25-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-26H2,1-2H3

Isómeros SMILES

CCCCCCCCCCCCCCCCCCCCCCCCCC

WGK Alemania

3

Peso molecular

366.71

Beilstein

1705609

Reaxy-Rn

1705609

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1705609&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Hydrocarbons
• Clase: 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
• Descripción: 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: an alkane

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 inflamación (°F): 419℉
• Punto de inflamación (°C): 215℃
• Punto de ebullición (°C): 420°C
• Punto de fusión (°C): 56-59°C
• Peso molecular: 366.700 g/mol
• XLogP3: 13.700
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 23
• Exact Mass: 366.423 Da
• Monoisotopic Mass: 366.423 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 26
• Formal Charge: 0
• Complexity: 196.000
• 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