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CAS 53400-42-3

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3-Pentanone, 1-(dimethylamino)-4,4-dimethyl-, hydrochloride (1:1)

Description:
3-Pentanone, 1-(dimethylamino)-4,4-dimethyl-, hydrochloride (1:1), with the CAS number 53400-42-3, is a chemical compound characterized by its structure, which includes a pentanone backbone substituted with a dimethylamino group and additional methyl groups. This compound typically appears as a white to off-white crystalline solid and is soluble in water due to the presence of the hydrochloride salt form. It is often used in organic synthesis and may exhibit properties such as moderate volatility and potential reactivity with various nucleophiles. The dimethylamino group can impart basic characteristics, making the compound a potential candidate for various applications in pharmaceuticals or as an intermediate in chemical reactions. Safety data should be consulted for handling, as it may pose health risks if inhaled or ingested. Overall, this compound's unique structure and properties make it of interest in both academic and industrial chemistry contexts.
Formula:C9H19NO·ClH
InChI:InChI=1S/C9H19NO.ClH/c1-9(2,3)8(11)6-7-10(4)5;/h6-7H2,1-5H3;1H
InChI key:InChIKey=NHRXYRRVZFAGOW-UHFFFAOYSA-N
SMILES:C(C(C)(C)C)(CCN(C)C)=O.Cl
Synonyms:
  • 3-Pentanone, 1-(dimethylamino)-4,4-dimethyl-, hydrochloride
  • 3-Pentanone, 1-(dimethylamino)-4,4-dimethyl-, hydrochloride (1:1)
  • 1-(Dimethylamino)-4,4-dimethyl-3-pentanone hydrochloride
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