2-Acetoxy-N,N,N-trimethylethanaminium bromide

Basic Information

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CAS Number

66-23-9

Molecular Formula

C7H16BrNO2

Molecular Weight

226.11 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Physical Properties

Melting Point

142.0 to 147.0 deg-C

Density

1.4246 (rough estimate)

Water Solubility

almost transparency

Refractive Index

1.6120 (estimate)

SMILES

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CC(=O)OCC[N+](C)(C)C.[Br-]

InChI

InChI=1S/C7H16NO2.BrH/c1-7(9)10-6-5-8(2,3)4;/h5-6H2,1-4H3;1H/q+1;/p-1

InChIKey

ZEHGKSPCAMLJDC-UHFFFAOYSA-M

LogP

-2.74030

Complexity

115

Safety Information

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GHS Hazard Pictograms

H315

H319

H335

Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Sensitiveness

Hygroscopic

Synonyms & References

English

(2-Acetoxyethyl)trimethylammonium bromide
Ethanaminium, 2-(acetyloxy)-N,N,N-trimethyl-, bromide (1:1)
2-acetyloxyethyl(trimethyl)azanium;bromide
C7H16NO2.Br
N,N-Trimethyl-2-acetoxyethylammonium bromide
NSC 4678
Tonocholin B
Pragmoline
C[N+](C)(C)CCOC(C)=O.[Br-]
NSC4678
ACETYLCHOLINE BROMIDE [MI]
Choline acetate (ester), bromide
2-(Acetyloxy)-N,N,N-trimethylethanaminium bromide (1:1)
CHEMBL1427664
CHEBI:55316
FT-0621823
Acetylcholine hydrobromide
66-23-9
REGID_for_CID_65551
UNII-C12HG588IF
Acetoxyethyl-trimethylammonium bromide
N,N,N-Trimethyl-2-acetoxyethylammonium bromide
DTXSID60883215
HMS2230N08
MFCD00011814
[2-(acetyloxy)ethyl]trimethylazanium bromide
SCHEMBL317763
HY-B0282A
(2-hydroxyethyltrimethyl)ammonium bromide acetate
MLS001148385
Acetylcholine (bromide)

MDL Number

MFCD00011814

Customs Code

29379000

FAQ

What is 2-Acetoxy-N,N,N-trimethylethanaminium bromide (CAS: 66-23-9)?

2-Acetoxy-N,N,N-trimethylethanaminium bromide (CAS: 66-23-9) is a quaternary ammonium compound with the molecular formula C7H19NOBr. It is a colorless to pale yellow liquid with a pungent odor. This compound is used in pharmaceuticals, as a reagent in organic synthesis, and as a component in cleaning agents.

What are the main uses of 2-Acetoxy-N,N,N-trimethylethanaminium bromide (CAS: 66-23-9)?

2-Acetoxy-N,N,N-trimethylethanaminium bromide (CAS: 66-23-9) is primarily used in pharmaceuticals as an intermediate in the synthesis of other compounds. It is also used as a reagent in organic chemistry and as a component in some cleaning and disinfectant products.

Is 2-Acetoxy-N,N,N-trimethylethanaminium bromide (CAS: 66-23-9) safe?

2-Acetoxy-N,N,N-trimethylethanaminium bromide (CAS: 66-23-9) is generally considered safe when used as directed. However, it should be handled with care due to its irritant properties. Protective gloves and safety goggles should be worn during handling, and it should be stored in a cool, dry place away from heat and direct sunlight to prevent degradation.

How should 2-Acetoxy-N,N,N-trimethylethanaminium bromide (CAS: 66-23-9) be stored?

2-Acetoxy-N,N,N-trimethylethanaminium bromide (CAS: 66-23-9) should be stored in a cool, dark place to avoid exposure to heat and light, which can cause degradation. Store it in a tightly sealed container to prevent moisture and air exposure. Keep it away from sources of ignition and incompatible materials like strong acids and bases.