Ethylhexadecyldimethylammonium bromide - ≥98% , CAS No.124-03-8

CAS: 124-03-8 Cat. No.: E111745 Formule: C₂₀H₄₄BrN Poids moléculaire: 378.47 Beilstein Registry Number: 3729134 Numéro CE: 204-672-8

QUALITÉ & PURETÉ ≥98%

Synonyms

EHDAB | 1-Hexadecanaminium, N-ethyl-N,N-dimethyl-, bromide (1:1) | J-005027 | Cetethyldimonium bromide | Cetyldimethylethylammonium bromide | Ethylhexadecyldimethylammonium bromide, >=98% (non-aqueous titration) | CETYLDIMETHYLETHYLAMMONIUM BROMIDE [MI] |

Storage

Store at 2-8°C

Shipped In

Wet ice

Vue d’ensemble

Ethylhexadecyldimethylammonium bromide is a surfactant.

Spécifications

Synonymes

EHDAB | 1-Hexadecanaminium, N-ethyl-N,N-dimethyl-, bromide (1:1) | J-005027 | Cetethyldimonium bromide | Cetyldimethylethylammonium bromide | Ethylhexadecyldimethylammonium bromide, >=98% (non-aqueous titration) | CETYLDIMETHYLETHYLAMMONIUM BROMIDE [MI] |

Spécifications et pureté

≥98%

Conditions de stockage de stockage

Store at 2-8°C

Expédié en

Wet ice

Ce produit nécessite l'expédition en chaîne froide. Les services terrestres et autres services économiques ne sont pas disponibles.

Pureté

≥98%

Noms et identifiants

Pubchem Sid

504753454

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504753454

Sourires canoniques

CCCCCCCCCCCCCCCC[N+](C)(C)CC.[Br-]

IUPAC Name

ethyl-hexadecyl-dimethylazanium;bromide

InChIKey

VUFOSBDICLTFMS-UHFFFAOYSA-M

INCHI

1S/C20H44N.BrH/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(3,4)6-2;/h5-20H2,1-4H3;1H/q+1;/p-1

Isomères SMILES

CCCCCCCCCCCCCCCC[N+](C)(C)CC.[Br-]

WGK Allemagne

3

RTECS

BQ5425000

Poids moléculaire

378.47

Beilstein

3729134

Reaxy-Rn

3729134

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3729134&ln=

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: 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
• Description: 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

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Mécanismes d'action

Propriétés chimiques et physiques

• Point d'éclair (°F): 93 °C
• Point d'éclair (°C): 93°C
• Point de fusion (°C): 190°C
• Poids moléculaire: 378.500 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 16
• Exact Mass: 377.266 Da
• Monoisotopic Mass: 377.266 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 22
• Formal Charge: 0
• Complexity: 198.000
• 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