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Dodecyldimethylbenzylammonium chloride(CAS No. 139-07-1)

Dodecyldimethylbenzylammonium chloride C21H38ClN (cas 139-07-1) Molecular Structure

139-07-1 Structure

Identification and Related Records

【Name】
Dodecyldimethylbenzylammonium chloride
【CAS Registry number】
139-07-1
【Synonyms】
Dodecyl dimethyl benzyl ammonium chloride
Benzenemethanaminium,N-dodecyl-N,N-dimethyl-, chloride (9CI)
Benzyldodecyldimethylammonium chloride(6CI)
Benzododecinium chloride
Benzyldimethyllaurylammonium chloride
Catigene OM
Catinal CB 50
Catiolite BC 50
Cationic1227
Cequartyl A
Croda N-Dodecyl
DYK 1125
Dehyquart LDB
N-Dodecyl-N,N-dimethyl-N-benzylammonium chloride
N-Dodecyl-N,N-dimethylbenzenemethanaminium chloride
【EINECS(EC#)】
205-351-5
【Molecular Formula】
C21H38ClN (Products with the same molecular formula)
【Molecular Weight】
339.99
【Inchi】
InChI=1/C21H38N.ClH/c1-4-5-6-7-8-9-10-11-12-16-19-22(2,3)20-21-17-14-13-15-18-21;/h13-15,17-18H,4-12,16,19-20H2,1-3H3;1H/q+1;/p-1
【Canonical SMILES】
CCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1.[Cl-]
【MOL File】
139-07-1.mol

Chemical and Physical Properties

【Appearance】
White Powder
【Melting Point】
60°C
【Computed Properties】
Molecular Weight:339.98612 [g/mol]
Molecular Formula:C21H38ClN
H-Bond Donor:0
H-Bond Acceptor:1
Rotatable Bond Count:13
Exact Mass:339.269278
MonoIsotopic Mass:339.269278
Topological Polar Surface Area:0
Heavy Atom Count:23
Formal Charge:0
Complexity:240
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

Safety and Handling

【Hazard Codes】
C,N:;
【Risk Statements】
R21/22
【Safety Statements 】
36/37/39-45-61-60-26
【Safety】

Poison by ingestion and intraperitoneal routes. A skin and eye irritant. When heated to decomposition it emits very toxic fumes of NOx, NH3, and Cl?.
Safety Information of?Dodecyldimethylbenzylammonium chloride (CAS NO.139-07-1):
Hazard Codes:?CorrosiveC,DangerousN
Risk Statements: 21/22-34-50-50/53
R21/22:Harmful in contact with skin and if swallowed.?
R34:Causes burns.?
R50:Very toxic to aquatic organisms.?
R50/53:Very toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment.
Safety Statements: 36/37/39-45-61-60-26
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection.?
S45:In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)?
S61:Avoid release to the environment. Refer to special instructions / safety data sheets.?
S60:This material and its container must be disposed of as hazardous waste.?
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
RIDADR: UN 3261 8/PG 3
WGK Germany: 2
RTECS: BO6821500
F: 3-10

【Transport】
OTH
【Specification】

?Dodecyldimethylbenzylammonium chloride , with CAS number of 139-07-1, can be called N-Benzyl-N-dodecyl-N,N-dimethylammonium chloride ; N-Dodecyl-N,N-dimethylbenzenemethanaminium chloride ; Lauryldimethylbenzylammonium chloride ; Lauryl benzalkonium chloride ; Dodecyldimethylbenzylammonium chloride ; Dodecylbenzyldimethylammonium chloride ; Dehyquart LDB ; Benzenemethanaminium,N-dodecyl-N,N-dimethyl-, chloride (9CI) ; Dodecyl dimethyl benzyl ammonium chloride . Dodecyldimethylbenzylammonium chloride (CAS NO.139-07-1) can be used for acrylic leveling agent, dyeing and printing fabrics slow dye, oil wells fungicides, cooling water system sterilization algicide, disinfectants, medical equipment, etc.

Biomedical Effects and Toxicity

【Pharmacological Action】
- Substances used on humans and other animals that destroy harmful microorganisms or inhibit their activity. They are distinguished from DISINFECTANTS, which are used on inanimate objects.
- Substances used on inanimate objects that destroy harmful microorganisms or inhibit their activity. Disinfectants are classed as complete, destroying SPORES as well as vegetative forms of microorganisms, or incomplete, destroying only vegetative forms of the organisms. They are distinguished from ANTISEPTICS, which are local anti-infective agents used on humans and other animals. (From Hawley's Condensed Chemical Dictionary, 11th ed)

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