ChemicalBook--->CAS DataBase List--->7281-04-1

7281-04-1

7281-04-1 Structure

7281-04-1 Structure
IdentificationMore
[Name]

Benzyldodecyldimethylammonium bromide
[CAS]

7281-04-1
[Synonyms]

BENZALKONIUM BROMIDE
BENZODODECINIUM BROMIDE
BENZYLDIMETHYLDODECYLAMMONIUM BROMIDE
BENZYLDODECYLDIMETHYLAMMONIUM BROMIDE
ammonylbr1244
bacforbl
Benzalkonlumbromide
Benzenemethanaminium,N-dodecyl-N,N-dimethyl-,bromide
benzyldodecyldimethyl-ammoniubromide
bromekdwumetylolaurylobenzyloamoniowy
Bromo-Geramine
dimethyllaurylbenzeneammoniumbromide
n-dodecyl-n,n-dimethyl-benzenemethanaminiubromide
N-Dodecyl-N,N-dimethylbenzenemethanaminiumbromide
N-Dodecyl-N,N-dimethylben-zylaminoniumbromide
sinnoquatbl80
sinnoquatbl95
sterinol
Dimethyl benzyl lauryl ammonium bromide
Dodecyl dimethyl benzyl ammonium bromide
[EINECS(EC#)]

230-698-4
[Molecular Formula]

C21H38BrN
[MDL Number]

MFCD00011768
[Molecular Weight]

384.44
[MOL File]

7281-04-1.mol
Chemical PropertiesBack Directory
[Melting point ]

50-55 °C
[Fp ]

110 °C
[storage temp. ]

2-8°C
[solubility ]

H2O: soluble0.1g/10 mL, clear, colorless to very faintly yellow
[form ]

powder to crystal
[color ]

Crystals
[BRN ]

3579193
[Cosmetics Ingredients Functions]

PRESERVATIVE
ANTISTATIC
[InChI]

InChI=1S/C21H38N.BrH/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]

KHSLHYAUZSPBIU-UHFFFAOYSA-M
[SMILES]

C1(=CC=CC=C1)C[N+](C)(C)CCCCCCCCCCCC.[Br-]
[CAS DataBase Reference]

7281-04-1(CAS DataBase Reference)
[EPA Substance Registry System]

7281-04-1(EPA Substance)
Safety DataBack Directory
[Symbol(GHS) ]

Skull and Crossbones (GHS06)
GHS06
[Signal word ]

Danger
[Hazard statements ]

H301-H315-H319-H335
[Precautionary statements ]

P301+P310+P330-P302+P352-P305+P351+P338
[Hazard Codes ]

Xn
[Risk Statements ]

R22:Harmful if swallowed.
R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
[RIDADR ]

UN 2811 6.1/PG 3
[WGK Germany ]

3
[RTECS ]

BO7875000
[TSCA ]

TSCA listed
[HazardClass ]

6.1(b)
[PackingGroup ]

III
[HS Code ]

29239000
[Storage Class]

6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
[Hazard Classifications]

Acute Tox. 3 Oral
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
[Toxicity]

LD50 orl-rat: 250 mg/kg RPZHAW 17,543,66
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Bromine-->Methylamine-->Benzyl chloride-->Benzyl bromide-->1-Dodecanol-->N,N-Dimethyldodecylamine-->N,N-Dimethylbenzylamine-->Dodecane-->1-Bromododecane
[Preparation Products]

Gemfibrozil-->4-Chlorobenzyl cyanide
Hazard InformationBack Directory
[Chemical Properties]

White to Off-White Low-Melting Solid
[Uses]

Benzalkonium bromides are an important class of cationic surfactants. They are used as preservatives for ophthalmic, nasal and parenteral products and they are also used as a topical antiseptic and medical equipment disinfectant.
[Definition]

ChEBI: Benzododecinium bromide is the organic bromide salt of benzododecinium. It is a cationic surfactant that has antispetic and disinfectant properties. It has a role as a surfactant, an antiseptic drug and a disinfectant. It is a quaternary ammonium salt and an organic bromide salt. It contains a benzododecinium.
[General Description]

Benzyldodecyldimethylammonium bromide is a cationic surfactant that may be used as an adsorbent for certain metals such as Cr(VI).
[Safety Profile]

Poison by ingestion andintraperitoneal routes. Whenheated to decomposition it emits very toxic fumes ofNH3, NOx, and Br -
Spectrum DetailBack Directory
[Spectrum Detail]

Benzyldodecyldimethylammonium bromide(7281-04-1)1HNMR
Benzyldodecyldimethylammonium bromide(7281-04-1)Raman
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

7281-04-1(sigmaaldrich)
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