N-Benzyl-N,N-diethylethanaminium bromide

Basic Information

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CAS Number

5197-95-5

Molecular Formula

C13H22BrN

Molecular Weight

272.22 g/mol

Chemical Classification

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

193-195 °C (dec.)

Refractive Index

1.5260 (estimate)

SMILES

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CC[N+](CC)(CC1=CC=CC=C1)CC.[Br-]

InChI

InChI=1S/C13H22N.BrH/c1-4-14(5-2,6-3)12-13-10-8-7-9-11-13;/h7-11H,4-6,12H2,1-3H3;1H/q+1;/p-1

InChIKey

CHQVQXZFZHACQQ-UHFFFAOYSA-M

LogP

0.06710

Complexity

135

Safety Information

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GHS Hazard Pictograms

H315

H319

Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Sensitiveness

Hygroscopic

Synonyms & References

English

N-Benzyl-N,N-diethylethanaminium bromide
TRIETHYLBENZYLAMMONIUM BROMIDE
BTEAB
N-Benzyl-N,N,N-triethylammonium bromide
BENZENEMETHANAMINIUM,N,N,N-TRIETHYL-,BROMIDE
Benzyltriethylazanium bromide
Benzyltriethylaminium·bromide
Triethylbenzylaminium·bromide
Benzyltriethylammonium bromide
Benzyl triethyl ammonium bromide (TEBA)
benzyl(triethyl)azanium,bromide
benzyl triethyl ammonium chloride
bromide
Ammonium,benzyltriethyl-, bromide (8CI)
Benzenemethanaminium, N,N,N-triethyl-, bromide(9CI)
Benzyltriethylammonium bromide (6CI,7CI)
Benzyl triethyl ammonium bromide

MDL Number

MFCD00011822

Customs Code

2827590000

FAQ

What is N-Benzyl-N,N-diethylethanaminium bromide (CAS: 5197-95-5)?

N-Benzyl-N,N-diethylethanaminium bromide is a quaternary ammonium bromide compound with the chemical formula C16H25BrNO. It is a white crystalline solid that is soluble in water and commonly used as a reagent in organic synthesis. The compound is known for its ability to act as a phase transfer catalyst and is characterized by its bromide counterion and benzyl group attached to the nitrogen-containing ethyl chain.

What are the main uses of N-Benzyl-N,N-diethylethanaminium bromide (CAS: 5197-95-5)?

N-Benzyl-N,N-diethylethanaminium bromide is primarily used in pharmaceutical and chemical research as a phase transfer catalyst. It facilitates reactions between aqueous and organic phases, enhancing reaction efficiency. It also finds applications in the synthesis of various organic compounds and can be used in the development of drugs and fine chemicals. Its utility in laboratory settings makes it a valuable compound for chemical processes and synthetic pathways.

Is N-Benzyl-N,N-diethylethanaminium bromide (CAS: 5197-95-5) safe?

N-Benzyl-N,N-diethylethanaminium bromide is generally considered safe when handled properly, but it should be treated with care. As a bromide salt, it may have mild irritant properties. It is important to follow standard safety protocols, such as wearing gloves and goggles, and ensuring proper ventilation. The compound is not classified as highly toxic, but its handling should comply with chemical safety guidelines to minimize risk.

How should N-Benzyl-N,N-diethylethanaminium bromide (CAS: 5197-95-5) be stored?

N-Benzyl-N,N-diethylethanaminium bromide should be stored in a cool, dry place away from light. It is typically kept in a sealed container to prevent moisture absorption and maintain stability. Storage conditions should be below 25°C and in a low-humidity environment. Avoid exposure to strong acids or bases to preserve its chemical integrity.