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CAS 13171-36-3

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Benzenemethanaminium, N,N-dimethyl-N-(2-oxopropyl)-, chloride (1:1)

Description:
Benzenemethanaminium, N,N-dimethyl-N-(2-oxopropyl)-, chloride (1:1), with CAS number 13171-36-3, is a quaternary ammonium compound characterized by its cationic nature due to the presence of a positively charged nitrogen atom. This compound features a benzene ring attached to a methanaminium group, which is further substituted with two methyl groups and a 2-oxopropyl moiety. The presence of the chloride ion indicates that it is a salt, contributing to its solubility in polar solvents. Typically, quaternary ammonium compounds exhibit surfactant properties, making them useful in various applications, including as disinfectants, emulsifiers, and in personal care products. The structure suggests potential biological activity, which may be explored in pharmacological contexts. Additionally, the compound's stability and reactivity can be influenced by the substituents on the nitrogen and the aromatic ring, affecting its interaction with other chemical species. Overall, this compound exemplifies the diverse functionalities of quaternary ammonium salts in both industrial and research settings.
Formula:C12H18NO·Cl
InChI:InChI=1S/C12H18NO.ClH/c1-11(14)9-13(2,3)10-12-7-5-4-6-8-12;/h4-8H,9-10H2,1-3H3;1H/q+1;/p-1
InChI key:InChIKey=OEEYPWMITPUJSX-UHFFFAOYSA-M
SMILES:C([N+](CC(C)=O)(C)C)C1=CC=CC=C1.[Cl-]
Synonyms:
  • Acetonylbenzyldimethylammonium chloride
  • Benzenemethanaminium, N,N-dimethyl-N-(2-oxopropyl)-, chloride (1:1)
  • Ammonium, acetonylbenzyldimethyl-, chloride
  • Benzenemethanaminium, N,N-dimethyl-N-(2-oxopropyl)-, chloride
  • N-Acetonyl-N,N-dimethylbenzylammonium chloride
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