Dimethyldioctadecylammonium Iodide - ≥98% , CAS No.7206-39-5

CAS: 7206-39-5 Cat. No.: D154854 Fórmula: C₃₈H₈₀IN Peso molecular: 677.97 Número CE: 805-800-0 PubChem CID: 14619958

GRADE & PURITY ≥98%

Synonyms

D4124 | D90253 | dimethyl(dioctadecyl)azanium;iodide | AKOS037646514 | SCHEMBL955745 | HY-W127662 | DIMETHYLDIOCTADECYLAZANIUM IODIDE | AS-69335 | Dimethyldistearylammonium Iodide | DTXSID60562290 | N,N-Dimethyl-N-octadecyloctadecan-1-aminium iodide | 1-O

Storage

Room temperature,Argon charged

Shipped In

Normal

Specifications

Sinónimos

D4124 | D90253 | dimethyl(dioctadecyl)azanium;iodide | AKOS037646514 | SCHEMBL955745 | HY-W127662 | DIMETHYLDIOCTADECYLAZANIUM IODIDE | AS-69335 | Dimethyldistearylammonium Iodide | DTXSID60562290 | N,N-Dimethyl-N-octadecyloctadecan-1-aminium iodide | 1-O

Especificações e pureza

≥98%

Condições de armazenamento de armazenamento

Room temperature,Argon charged

Enviado em

Normal

Pureza

≥98%

Nomes e identificadores

• Pubchem Sid: 504767688
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504767688
• Sorrisos canónicos: CCCCCCCCCCCCCCCCCC[N+](C)(C)CCCCCCCCCCCCCCCCCC.[I-]
• IUPAC Name: dimethyl(dioctadecyl)azanium;iodide
• InChIKey: MSSPASWTWTZPQU-UHFFFAOYSA-M
• INCHI: 1S/C38H80N.HI/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39(3,4)38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2;/h5-38H2,1-4H3;1H/q+1;/p-1
• SMILES isoméricas: CCCCCCCCCCCCCCCCCC[N+](C)(C)CCCCCCCCCCCCCCCCCC.[I-]
• PubChem CID: 14619958
• Peso molecular: 677.97
• Reaxy-Rn: 3799941

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Classe Organonitrogen compounds
      • Subclass Quaternary ammonium salts

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Classe: Organonitrogen compounds
• Subclass: Quaternary ammonium salts
• Intermediate Tree Nodes: Not available
• Direct Parent: Tetraalkylammonium salts
• Alternative Parents: Organic iodide salts Hydrocarbon derivatives Amines Organic cations
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Tetraalkylammonium salt - Hydrocarbon derivative - Organic iodide salt - Organic salt - Amine - Organic cation - Aliphatic acyclic compound
• Descrição: This compound belongs to the class of organic compounds known as tetraalkylammonium salts. These are organonitrogen compounds containing a quaternary ammonium substituted with four alkyl chains.
• 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

Propriedades químicas e físicas

• Sensibilidade: Air Sensitive,Hygroscopic
• Ponto de fusão (°C): 154 °C
• Peso molecular: 678.000 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 34
• Exact Mass: 677.534 Da
• Monoisotopic Mass: 677.534 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 40
• Formal Charge: 0
• Complexity: 390.000
• 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: 2

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