ChemicalBook--->CAS DataBase List--->3700-67-2

3700-67-2

3700-67-2 Structure

3700-67-2 Structure
IdentificationMore
[Name]

Dimethyldioctadecylammonium bromide
[CAS]

3700-67-2
[Synonyms]

18:0 DDAB
DDA
DDAB
DIMETHYL DI-N-OCTADECYLAMMONIUM BROMIDE
DIMETHYLDIOCTADECYLAMMONIUM BROMIDE
DIMETHYLDISTEARYLAMMONIUM BROMIDE
DISTEARYLDIMETHYLAMMONIUM BROMIDE
N,N-DIMETHYL-N,N-DISTEARYLAMMONIUM BROMIDE
n,n-dimethyl-n-octadecyl-1-octadecanaminiubromide
Dioctadecyl dimethyl ammonium bromide
Dimethyldioctadecylammonium bromide, 99+%
1-Octadecanaminium, N,N-dimethyl-N-octadecyl-, bromide
DIMETHYLDIOXTYLADECYLAMMONIUMBROMIDE
DDAB
DODAB
Bis(octadecyl)dimethylammonium bromide
Dioctadecanyldimethylammonium bromide
DODA(Br)
ERBU Adjuvant 100
Dimethylbis(octadecyl)aminium·bromide
[EINECS(EC#)]

223-037-6
[Molecular Formula]

C38H80BrN
[MDL Number]

MFCD00041975
[Molecular Weight]

630.95
[MOL File]

3700-67-2.mol
Chemical PropertiesBack Directory
[Appearance]

white powder
[Melting point ]

~160 °C
[density ]

1.047
[refractive index ]

1.5260 (estimate)
[RTECS ]

RG0185984
[storage temp. ]

-20°C
[solubility ]

Chloroform (Slightly), Ethyl Acetate (Slightly, Heated), Hexanes (Slightly, Heated)
[form ]

Granular Powder
[color ]

White
[Stability:]

Stable. Incompatible with strong oxidizing agents.
[BRN ]

3580323
[InChI]

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
[InChIKey]

PSLWZOIUBRXAQW-UHFFFAOYSA-M
[SMILES]

C(CCCCCCCCCCCCCCCCC)[N+](C)(C)CCCCCCCCCCCCCCCCCC.[Br-]
[CAS DataBase Reference]

3700-67-2(CAS DataBase Reference)
[EPA Substance Registry System]

3700-67-2(EPA Substance)
Safety DataBack Directory
[Symbol(GHS) ]

Skull and Crossbones (GHS06)Health Hazard (GHS08)
GHS06,GHS08
[Signal word ]

Danger
[Hazard statements ]

H302-H315-H319-H331-H336-H351-H361d-H372-H412
[Precautionary statements ]

P201-P273-P301+P312+P330-P302+P352-P304+P340+P311-P308+P313
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
R43:May cause sensitization by skin contact.
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S37/39:Wear suitable gloves and eye/face protection .
[WGK Germany ]

3
[TSCA ]

Yes
[HazardClass ]

9
[HS Code ]

29211990
[Storage Class]

11 - Combustible Solids
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Dimethylamine-->1-Bromooctadecane
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

DDAB(3700-67-2).msds
Hazard InformationBack Directory
[Description]

18:0 DDAB is a double-chained quaternary ammonium surfactant with a bromide counter ion.
[Chemical Properties]

white powder
[Uses]

Dimethyldioctadecylammonium bromide has been used in a study to assess the interaction of its monolayers with DNA using specular neutron reflection, surface pressure-area isotherms, and Brewster angle microscopy. It has also been used in a study to investigate new adjuvants for use in kill vaccines for bovine viral diarrhea virus (BVDV).
[General Description]

18:0 DDAB is cationic lipid and a quaternary ammonium salt. The hydrocarbon tails are saturated unlike the ionizable lipids.
[Biochem/physiol Actions]

18:0 DDAB is a surface-active molecule, used as an adjuvant to induce systemic immune response. It is non-toxic.
[Purification Methods]

Crystallise the bromide from acetone, then MeOH [Lukac J Am Chem Soc 106 4387 1984]. Also purify it by chromatography on alumina by washing with *C6H6 and eluting with Me2CO, evaporating and crystallising from MeCN [Swain & Kreevoy J Am Chem Soc 77 1126 1955]. [Beilstein 4 IV 829.]
Spectrum DetailBack Directory
[Spectrum Detail]

Dimethyldioctadecylammonium bromide(3700-67-2)MS
Dimethyldioctadecylammonium bromide(3700-67-2)1HNMR
Dimethyldioctadecylammonium bromide(3700-67-2)13CNMR
Dimethyldioctadecylammonium bromide(3700-67-2)IR1
Dimethyldioctadecylammonium bromide(3700-67-2)IR2
Dimethyldioctadecylammonium bromide(3700-67-2)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

Dimethyldioctadecylammonium bromide, 99+%(3700-67-2)
[Alfa Aesar]

Dimethyldi-n-octadecylammonium bromide, 99%(3700-67-2)
[Sigma Aldrich]

3700-67-2(sigmaaldrich)
[TCI AMERICA]

Dimethyldioctadecylammonium Bromide,>98.0%(T)(3700-67-2)
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