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ChemicalBook--->CAS DataBase List--->139-07-1

139-07-1

139-07-1 Structure

139-07-1 Structure
IdentificationMore
[Name]

1227
[CAS]

139-07-1
[Synonyms]

1227
BENZYLDIMETHYLDODECYLAMMONIUM CHLORIDE
BENZYLDODECYLDIMETHYLAMMONIUM CHLORIDE
c12-alkylbenzyldimethylammonium chloride
DIMETHYLBENZYLLAURYLAMMONIUM CHLORIDE
DODECYL DIMETHYL BENZYL AMMONIUM CHLORIDE
LAURYLDIMETHYLBENZYL AMMONIUM CHLORIDE
n-dodecyl-n,n-dimethyl-benzenemethanaminium chloride
Benzenemethanaminium,N-dodecyl-N,N-dimethyl-,chloride
benzyldimethyldodecyl-ammoniuchloride
benzyldodecyldimethyl-ammoniuchloride
benzyl-lauryldimethylammoniumchloride
Cationicsurfaceactiveagent1227
dodecyldimethylbenzylammonium
Levellingagent1227
N,N-Dimethyl-N-dodecylbenzylaminiumchloride
n-dodecyl-n,n-dimethyl-benzenemethanaminiuchloride
OspintTAN
Surfactant1227
C12-alkylbenzyldimethylammonium chloride
[EINECS(EC#)]

205-351-5
[Molecular Formula]

C21H38ClN
[MDL Number]

MFCD00137276
[Molecular Weight]

339.99
[MOL File]

139-07-1.mol
Chemical PropertiesBack Directory
[Melting point ]

~60 °C
[Boiling point ]

162.7℃[at 101 325 Pa]
[density ]

1.03[at 20℃]
[vapor pressure ]

0Pa at 20℃
[storage temp. ]

Sealed in dry,Room Temperature
[solubility ]

866g/L in organic solvents at 20 ℃
[form ]

Solid
[color ]

White to Off-White
[Water Solubility ]

2g/L at 20℃
[BRN ]

3921689
[Stability:]

Hygroscopic
[InChI]

InChI=1S/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
[InChIKey]

JBIROUFYLSSYDX-UHFFFAOYSA-M
[SMILES]

C1(=CC=CC=C1)C[N+](C)(C)CCCCCCCCCCCC.[Cl-]
[LogP]

2.63
[CAS DataBase Reference]

139-07-1(CAS DataBase Reference)
[EPA Substance Registry System]

139-07-1(EPA Substance)
Safety DataBack Directory
[Hazard Codes ]

C,N
[Risk Statements ]

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 ]

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 label where possible) .
S61:Avoid release to the environment. Refer to special instructions safety data sheet .
S60:This material and/or 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
[TSCA ]

Yes
[HazardClass ]

8
[PackingGroup ]

III
[HS Code ]

29239000
[Toxicity]

LD50 oral in rat: 400mg/kg
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Sodium carbonate-->Benzyl chloride-->Triethanolamine-->1-Dodecanol
[Preparation Products]

softener TC-->softener FS-->benzyl(heptadecyl)dimethylammonium chloride-->4-Hydroxy-3-nitrobenzotrifluoride
Hazard InformationBack Directory
[Chemical Properties]

White fine crystalline powder
[Uses]

Quaternary ammonium composition to treat herpes, pseudomonas, staph, hepatitis and other infectious diseases.
[Definition]

ChEBI: Benzododecinium chloride is the organic chloride salt of benzododecinium. It has antiseptic and disinfectant properties, and used as a preservative in eye drop formulations. It has a role as an antiseptic drug, a disinfectant, an antifouling biocide and a surfactant. It is a quaternary ammonium salt and an organic chloride salt. It contains a benzododecinium.
[Flammability and Explosibility]

Notclassified
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

139-07-1(sigmaaldrich)
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