Bromuro de dimetildioctadecilamonio - ≥98% , CAS No.3700-67-2

CAS: 3700-67-2 Cat. No.: D130818 Peso molecular: 630.952 Beilstein Registry Number: 3580323 Número EC: 223-037-6

GRADE & PURITY ≥98%

Synonyms

FT-0625134 | Z5T47R065A | 57PD1RF6G7 | UNII-Z5T47R065A | W-106572 | HY-131119 | Distearyldimethylammonium bromide | n-Octadecyl acetate | Q27295043 | MFCD00041975 | 1-Octadecanaminium, N,N-dimethyl-N-octadecyl-, bromide | DISTEARYLDIMONIUM BROMIDE | 1-Oct

Storage

Argon charged,Desiccated,Room temperature

Shipped In

Normal

Application

Drug Delivery, Surface Modification, PEGylation of Protein, Peptide & Oligo

Specifications

Sinónimos

FT-0625134 | Z5T47R065A | 57PD1RF6G7 | UNII-Z5T47R065A | W-106572 | HY-131119 | Distearyldimethylammonium bromide | n-Octadecyl acetate | Q27295043 | MFCD00041975 | 1-Octadecanaminium, N, N-dimethyl-N-octadecyl-, bromide | DISTEARYLDIMONIUM BROMIDE | 1-Oct

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Argon charged, Desiccated, Room temperature

Enviado en

Normal

Pureza

≥98%

Nombres e identificadores

• Pubchem Sid: 488185392
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488185392
• Sonrisas canónicas: CCCCCCCCCCCCCCCCCC[N+](C)(C)CCCCCCCCCCCCCCCCCC.[Br-]
• IUPAC Name: dimethyl(dioctadecyl)azanium;bromide
• InChIKey: PSLWZOIUBRXAQW-UHFFFAOYSA-M
• INCHI: 1S/C38H80N.BrH/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
• Isómeros SMILES: CCCCCCCCCCCCCCCCCC[N+](C)(C)CCCCCCCCCCCCCCCCCC.[Br-]
• WGK Alemania: 3
• CAS alternativo: 14357-21-2
• Peso molecular: 630.952
• Beilstein: 3580323
• Reaxy-Rn: 3580323
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3580323&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Clase: Organonitrogen compounds
• Subclass: Quaternary ammonium salts
• Intermediate Tree Nodes: Not available
• Direct Parent: Tetraalkylammonium salts
• Alternative Parents: Organopnictogen compounds Organic bromide salts Hydrocarbon derivatives Amines
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Tetraalkylammonium salt - Organopnictogen compound - Hydrocarbon derivative - Organic bromide salt - Organic salt - Amine - Aliphatic acyclic compound
• Descripción: 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

Propiedades químicas y físicas

• Punto de fusión (°C): 155 °C
• Peso molecular: 631.000 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 34
• Exact Mass: 629.547 Da
• Monoisotopic Mass: 629.547 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

XLogP3

Referencias

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