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68207-00-1

Basic Information
CAS No.: 68207-00-1
Name: Dodecylethyldimethylammonium bromide
Article Data: 4
Molecular Structure:
Molecular Structure of 68207-00-1 (Dodecylethyldimethylammonium bromide)
Formula: C16H36 N . Br
Molecular Weight: 322.373
Synonyms: 1-Dodecanaminium,N-ethyl-N,N-dimethyl-, bromide (9CI); Dodecylethyldimethylammonium bromide(6CI); N-Ethyl-N,N-dimethyl-N-dodecylammonium bromide
EINECS: 269-249-2
Melting Point: 185-188 °C(lit.)
Solubility: H2O: 50 mg/mL, clear, colorless
Appearance: WHITE CRYSTALLINE POWDER
Hazard Symbols:
Risk Codes: R36/37/38   
Safety: 26-36
PSA: 0.00000
LogP: 2.00760
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  • 68207-00-1                 C16H36BrN              Dodecylethyldimethylammonium bromide

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Chemistry

Molecular structure of Dodecylethyldimethylammonium bromide (CAS NO.68207-00-1) is:

Product Name: Dodecylethyldimethylammonium bromide
CAS Registry Number: 68207-00-1
IUPAC Name: Dodecyl-ethyl-dimethylazanium bromide
Molecular Weight: 322.36774 [g/mol]  
Molecular Formula: C16H36BrN  
H-Bond Donor: 0  
H-Bond Acceptor: 1
EINECS: 269-249-2
Melting Point: 185-188 °C
Solubility: H2O: 50 mg/mL, clear, colorless
Canonical SMILES: CCCCCCCCCCCC[N+](C)(C)CC.[Br-]
InChI: InChI=1S/C16H36N.BrH/c1-5-7-8-9-10-11-12-13-14-15-16-17(3,4)6-2;/h5-16H2,1-4H3;1H/q+1;/p-1 
InChIKey: FFGSPQDSOUPWGY-UHFFFAOYSA-M

Safety Profile

Safty information about Dodecylethyldimethylammonium bromide (CAS NO.68207-00-1) is:
Hazard Codes: IrritantXi
Risk Statements: 36/37/38 
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 26-36 
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 
S36:Wear suitable protective clothing.
WGK Germany: 3
F: 3

Specification

 Dodecylethyldimethylammonium bromide , its cas register number is 68207-00-1. It also can be called 1-Dodecanaminium,N-ethyl-N,N-dimethyl-, bromide (1:1) ; N-ethyl-N,N-dimethyldodecan-1-aminium bromide .