N-Benzyl-N,N-dimethyl-1-tetradecanaminium chloride

Basic Information

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CAS Number

85409-22-9

Molecular Formula

C23H42ClN

EINECS

939-350-2

Chemical Classification

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

73°C

Boiling Point

102℃ at 101.3kPa

Density

0.96-929 at 20℃

Flash Point

>100°C

Solubility

Benzalkonium chloride is soluble in water (100 mg/ml), yielding a clear, colorless to faint yellow solution. It is also very soluble in alcohol and acetone, slightly soluble in benzene, and almost insoluble in ether.Solutions may be autoclaved or aseptically filtered.

Vapor Pressure

0.001-0.006Pa at 20-50℃

SMILES

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CCCCCCCCCCCCCC[N+](C)(C)Cc1ccccc1.[Cl-]

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

LogP

-0.21-2.75 at 20℃

Safety Information

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Auto-ignition Temperature

>250 °C Dust

Synonyms & References

English

Quaternary ammonium compounds, benzyl-C12-14-alkyldimethyl, chlorides
Benzyl-C12-14-alkyldimethylammonium chlorides
N-Alkyl-(C12-C14)-N-benzyl-N,N-dimethylammonium chloride
benzyl C12-14 alkyldimethylammonium chloride
Barquat(R) MS-100
N-Alkyl(C12-16)-N,N-dimethyl-N-benzylammonium chloride
Alkylbenzyldimethylammonium chlorides, benzyl-C12-14-alkyldimethyl
B 50 (Surgactant)
Benzalkonium Chloride

MDL Number

MFCD09998211

EC Number

939-350-2

Customs Code

3402 12 00

FAQ

What are the physical and chemical properties of N-Benzyl-N,N-dimethyl-1-tetradecanaminium chloride (CAS: 85409-22-9)?

N-Benzyl-N,N-dimethyl-1-tetradecanaminium chloride (CAS: 85409-22-9) is a white crystalline solid with a high molecular weight of approximately 422.5 g/mol. It is slightly soluble in water and highly soluble in organic solvents. Chemically, it is stable under normal conditions but can degrade in strong bases or acids. It exhibits low reactivity under standard laboratory conditions.

How is N-Benzyl-N,N-dimethyl-1-tetradecanaminium chloride (CAS: 85409-22-9) typically synthesized?

N-Benzyl-N,N-dimethyl-1-tetradecanaminium chloride is typically synthesized through the reaction of 1-tetradecanamine with benzyl chloride in the presence of a base, such as sodium hydroxide, at room temperature. The process yields a high product selectivity and a good yield, around 85-90%.

What industries use N-Benzyl-N,N-dimethyl-1-tetradecanaminium chloride (CAS: 85409-22-9)?

N-Benzyl-N,N-dimethyl-1-tetradecanaminium chloride (CAS: 85409-22-9) is used in various industries, including pharmaceuticals for drug delivery systems, sensors for chemical detection, and polymers for functionalization. It is also applicable in semiconductor manufacturing for etching processes.

What precautions should be taken when handling N-Benzyl-N,N-dimethyl-1-tetradecanaminium chloride (CAS: 85409-22-9)?

When handling N-Benzyl-N,N-dimethyl-1-tetradecanaminium chloride (CAS: 85409-22-9), it is important to wear appropriate personal protective equipment (PPE), including gloves and safety goggles. Work should be performed in a well-ventilated area or fume hood. In case of a spill, neutralize with an appropriate acid or base and dispose of according to local regulations. Always refer to the Safety Data Sheet (SDS) for detailed handling instructions.