1-Octadecanaminium, N,N-dimethyl-N-octadecyl-, bromide


Chemical Name: 1-Octadecanaminium, N,N-dimethyl-N-octadecyl-, bromide
CAS Number: 3700-67-2
Product Number: AG00BXU3(AGN-PC-0JLQLJ)
Synonyms:
MDL No:
Molecular Formula: C38H80BrN
Molecular Weight: 630.9525

Identification/Properties


Properties
MP:
~160 °C
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
630.969g/mol
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
34
Exact Mass:
629.547g/mol
Monoisotopic Mass:
629.547g/mol
Topological Polar Surface Area:
0A^2
Heavy Atom Count:
40
Formal Charge:
0
Complexity:
391
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
2
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



Dimethyldioctadecylammonium Bromide, also known as DODAB, is a quaternary ammonium compound commonly used in chemical synthesis. This versatile compound is particularly valued for its cationic properties, which make it an effective surfactant and stabilizer in various chemical reactions. In organic synthesis, DODAB can be utilized as a phase transfer catalyst, facilitating the transfer of reactants between immiscible phases. This allows for improved efficiency and selectivity in a wide range of chemical transformations. Additionally, DODAB can act as a template or structure-directing agent in the synthesis of mesoporous materials, such as silica nanoparticles or polymers. Its unique molecular structure and amphiphilic nature make Dimethyldioctadecylammonium Bromide a valuable tool in the realm of chemical synthesis.