Dimethyldioctadecylammonium bromide supplier

Name
Dimethyldioctadecylammonium bromide
EINECS 223-037-6
CAS No. 3700-67-2
Article Data5
CAS DataBase
Density 1.047 g/cm³
Solubility
Melting Point ~160 °C
Formula C₃₈H₈₀N^.Br
Boiling Point
Molecular Weight 630.964
Flash Point
Transport Information
Appearance white powder
Safety 26-37/39
Risk Codes 36/37/38-43
Molecular Structure
Hazard Symbols Xi
Synonyms 1-Octadecanaminium,N,N-dimethyl-N-octadecyl-, bromide (9CI);Ammonium, dimethyldioctadecyl-, bromide(8CI);Dimethyldioctadecylammonium bromide (6CI,7CI);Bis(octadecyl)dimethylammonium bromide;DODA(Br);DODAB;DSDMAB;Di-n-octadecyldimethylammonium bromide;Dimethyldistearylammonium bromide;Dioctadecanyldimethylammonium bromide;Dioctadecyldimethylammonium bromide;Distearyldimethylammonium bromide;GERBUAdjuvant 10;GERBU Adjuvant 100;VSA 3;
PSA 0.00000
LogP 10.58980

Dimethyldioctadecylammonium bromide Specification

The CAS register number of Dimethyldioctadecylammonium bromide is 3700-67-2. It also can be called as Distearyldimethylammonium bromide and the IUPAC name about this chemical is dimethyl(dioctadecyl)azanium bromide. It belongs to the following product categories, such as Ammonium Bromides (Quaternary), Quaternary Ammonium Compounds and so on.

Physical properties about Dimethyldioctadecylammonium bromide are: (1)ACD/LogP: 9.42; (2)# of Rule of 5 Violations: 2; (3)ACD/LogD (pH 5.5): 9.41; (4)ACD/LogD (pH 7.4): 9.41; (5)ACD/BCF (pH 5.5): 1000000; (6)ACD/BCF (pH 7.4): 1000000; (7)ACD/KOC (pH 5.5): 3151619; (8)ACD/KOC (pH 7.4): 3151619; (9)#H bond acceptors: 1; (10)#Freely Rotating Bonds: 34.

Uses of Dimethyldioctadecylammonium bromide: it can be used to produce dioctadecyldimethylammonium p-styrenesulfonate with sodium 4-vinylbenzenesulphonate at temperature of 70 ℃. This reaction will need solvent H₂O. The yield is about 95%.

When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin and it may cause sensitization by skin contact. When you are using it, wear suitable gloves and eye/face protection. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: [Br-].C(CCCCC[N+](C)(CCCCCCCCCCCCCCCCCC)C)CCCCCCCCCCCC
(2)InChI: InChI=1/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
(3)InChIKey: PSLWZOIUBRXAQW-REWHXWOFAH
(4)Std. 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
(5)Std. InChIKey: PSLWZOIUBRXAQW-UHFFFAOYSA-M

Product Name

Dimethyldioctadecylammonium bromide

Dimethyldioctadecylammonium bromide Specification

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