ChemicalBook--->CAS DataBase List--->139-08-2

139-08-2

139-08-2 Structure

139-08-2 Structure
IdentificationMore
[Name]

Tetradecyldimethylbenzylammonium chloride
[CAS]

139-08-2
[Synonyms]

BENZALKONIUM CHLORIDE
BENZYLDIMETHYLTETRADECYLAMMONIUM CHLORIDE
BENZYLTETRADECYLDIMETHYLAMMONIUM CHLORIDE
MKC
MYRISTALKONIUM CHLORIDE
MYRISTYLBENZYLDIMETHYLAMMONIUM CHLORIDE
MYRISTYLDIMETHYLBENZYLAMMONIUM CHLORIDE
MYRISTYLTRIMETHYLAMMONIUM CHLORIDE
TDBAC
TETRADECYLBENZYL-DIMETHYL-AMMONIUM CHLORIDE
TETRADECYLDIMETHYLBENZYLAMMONIUM CHLORIDE
ZEPHIRAMINE
ZEPHIRAN CHLORIDE
ZEPHIROL
alkyl
alkyl(100%c14)dimethylbenzyl
alkyl(100%c14)dimethylbenzylammoniumchloride
alkyl(100%c14)dimethylbenzylammoniumchloridechemical
arquaddm14b-90
barquatmb50
[EINECS(EC#)]

205-352-0
[Molecular Formula]

C23H42ClN
[MDL Number]

MFCD00011771
[Molecular Weight]

368.04
[MOL File]

139-08-2.mol
Chemical PropertiesBack Directory
[Definition]

Aquaternary ammonium compound. Free-flowingpowder.
[Melting point ]

56-62 °C
[density ]

1.02[at 20℃]
[vapor pressure ]

0Pa at 25℃
[storage temp. ]

2-8°C
[solubility ]

water: soluble1g/10 mL, clear, colorless
[form ]

White powder
[color ]

White to Almost white
[Water Solubility ]

almost transparency
[Detection Methods]

T
[Merck ]

1059
[Henry's Law Constant]

7.6×105 mol/(m3Pa) at 25℃, HSDB (2015)
[Stability:]

Hygroscopic
[Cosmetics Ingredients Functions]

PRESERVATIVE
[InChI]

InChI=1S/C23H42N.ClH/c1-4-5-6-7-8-9-10-11-12-13-14-18-21-24(2,3)22-23-19-16-15-17-20-23;/h15-17,19-20H,4-14,18,21-22H2,1-3H3;1H/q+1;/p-1
[InChIKey]

OCBHHZMJRVXXQK-UHFFFAOYSA-M
[SMILES]

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

3.2 at 20℃
[CAS DataBase Reference]

139-08-2(CAS DataBase Reference)
[EPA Substance Registry System]

139-08-2(EPA Substance)
Safety DataBack Directory
[Symbol(GHS) ]

Corrosion (GHS05)Exclamation Mark (GHS07)Environment (GHS09)Skull and Crossbones (GHS06)
GHS05,GHS07,GHS09,GHS06
[Signal word ]

Danger
[Hazard statements ]

H301-H312+H332-H302-H312-H318-H302+H312-H314-H400
[Precautionary statements ]

P260h-P301+P330+P331-P303+P361+P353-P501a-P260-P264-P270-P271-P301+P330+P331+P310-P303+P361+P353+P310+P363-P304+P340+P310-P305+P351+P338+P310-P391-P405-P501-P273-P280-P305+P351+P338-P310
[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 ]

3
[RTECS ]

BO7150000
[F ]

3
[TSCA ]

Yes
[REACH Registrations]

Active
[HazardClass ]

8
[PackingGroup ]

III
[HS Code ]

29239000
[Storage Class]

8A - Combustible corrosive hazardous materials
[Hazard Classifications]

Acute Tox. 4 Oral
Aquatic Acute 1
Aquatic Chronic 1
Eye Dam. 1
Skin Corr. 1B
[Safety Profile]

A skin and eye irritant. When heated to decomposition it emits very toxic fumes of NOx, NH3, and Cl-.
[Hazardous Substances Data]

139-08-2(Hazardous Substances Data)
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Benzyl chloride-->1-Tetradecylamine-->Benzalkonium chloride
Hazard InformationBack Directory
[Chemical Properties]

White powder
[Uses]

A quaternary ammonium halide
[Flammability and Explosibility]

Notclassified
Spectrum DetailBack Directory
[Spectrum Detail]

Tetradecyldimethylbenzylammonium chloride(139-08-2)MS
Tetradecyldimethylbenzylammonium chloride(139-08-2)1HNMR
Tetradecyldimethylbenzylammonium chloride(139-08-2)13CNMR
Tetradecyldimethylbenzylammonium chloride(139-08-2)IR1
Tetradecyldimethylbenzylammonium chloride(139-08-2)IR2
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

139-08-2(sigmaaldrich)
[TCI AMERICA]

Benzyldimethyltetradecylammonium Chloride  Hydrate,>98.0%(T)(139-08-2)
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