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2-[2,2-Diphenyl(2-propyn-1-yloxy)acetoxy]-N,N-dimethylethanaminium chloride(CAS: 2765-97-1)

2-[2,2-Diphenyl(2-propyn-1-yloxy)acetoxy]-N,N-dimethylethanaminium chloride
CAS Number

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Basic Information

Molecular Formula
C21H24ClNO3
Molecular Weight
373.9 g/mol

Chemical Identifiers

SMILES
CN(C)CCOC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)OCC#C.Cl
InChIKey
RSBGQTFIHFGTSY-UHFFFAOYSA-N

Database References

MDL Number
MFCD01672345

FAQ

The compound has a crystalline form. Its molecular weight is approximately 612.39 g/mol. It is sparingly soluble in water but soluble in organic solvents. It is highly reactive due to the presence of functional groups such as ester and amine. The compound exhibits moderate acidity and basicity.
The compound can be synthesized using a multi-step procedure involving acetylation, esterification, and alkylation reactions. The key steps include reacting a phenolic compound with propargyl chloride followed by acetylation and then N,N-dimethylation. The overall yield is moderate, typically around 70-80%.
This compound is used in the pharmaceutical industry for its potential as a drug candidate. It may also be used in the polymer industry for modifying polymer properties. Additionally, it could find applications in semiconductor technology due to its functional groups, and in sensor technology for its reactivity.
Handle the compound with appropriate personal protective equipment (PPE) such as gloves and goggles. It should be stored in a fume hood to minimize exposure. In case of a spill, immediately clean up with the appropriate absorbent material and dispose of in accordance with safety data sheet (SDS) guidelines. Ensure proper ventilation and avoid inhalation or contact with eyes and skin.

Safety Notice

Please verify product specifications and safety data before use. Contact the supplier for detailed safety information.

Always follow proper handling procedures

Contact Information

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