Nonacosane - ≥99% , CAS No.630-03-5

CAS: 630-03-5 Cat. No.: N111740 Fórmula: C₂₉H₆₀ Peso molecular: 408.79 Beilstein Registry Number: 1724922 Número EC: 211-126-2

CALIDAD & PUREZA ≥99%

Synonyms

Nonacosane, analytical standard | UNII-IGL1697BK1 | Nonacosane; Celidoniol, deoxy- (7CI); n-Nonacosane | AI3-36284 | CH3-(CH2)27-CH3 | N-BOC-4-NITRO-L-PHENYLALANINE-T-BUTYLESTER | CHEBI:7613 | DTXCID8043602 | EINECS 211-126-2 | DC7C60EC-A78D-4260-BEE6-924

Storage

Room temperature

Shipped In

Normal

Descripción general

product description：

Nonacosane is a major paraffin of most plant waxes.The metabolic fate of n-nonacosane (from cabbage wax) in Micrococcus cerificans, a soil organism has been investigated. Solubility of solid n-nonacosane in supercritical ethane has been reported.

Especificaciones

Sinónimos

Nonacosane, analytical standard | UNII-IGL1697BK1 | Nonacosane; Celidoniol, deoxy- (7CI); n-Nonacosane | AI3-36284 | CH3-(CH2)27-CH3 | N-BOC-4-NITRO-L-PHENYLALANINE-T-BUTYLESTER | CHEBI:7613 | DTXCID8043602 | EINECS 211-126-2 | DC7C60EC-A78D-4260-BEE6-924

Especificaciones y pureza

≥99%

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Pureza

≥99%

Nombres e identificadores

Pubchem Sid

488181664

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488181664

Sonrisas canónicas

CCCCCCCCCCCCCCCCCCCCCCCCCCCCC

IUPAC Name

nonacosane

InChIKey

IGGUPRCHHJZPBS-UHFFFAOYSA-N

INCHI

1S/C29H60/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-29H2,1-2H3

Isómeros SMILES

CCCCCCCCCCCCCCCCCCCCCCCCCCCCC

WGK Alemania

3

Número ONU

1325

Peso molecular

408.79

Beilstein

1724922

Reaxy-Rn

1724922

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1724922&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

Mecanismos de acción

Propiedades químicas y físicas

• Solubilidad: Solubility in Toluene almost transparency
• Punto de ebullición (°C): 286°C
• Punto de fusión (°C): 63-66°C
• Peso molecular: 408.800 g/mol
• XLogP3: 15.300
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 26
• Exact Mass: 408.47 Da
• Monoisotopic Mass: 408.47 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 29
• Formal Charge: 0
• Complexity: 231.000
• 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