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CS-W001157 4
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2-Methylpiperidin-4-one hydrochloride

  • CAS No. 13729-77-6

  • Cat. No. CS-0012636
  • Purity≥97%
  • MDL No.MFCD08669336

*For research and further manufacturing use only, not for direct human use.

2-Methylpiperidin-4-one hydrochloride|CS-0012636

Structure of 13729-77-6

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General Information

  • CAS No. 13729-77-6
  • Cat. No. CS-0012636
  • Purity ≥97%
  • MDL No. MFCD08669336
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₁₂ClNO
  • Molecular Weight 149.62
  • Synonym(s) 2-METHYL-4-PIPERIDINONE HYDROCHLORIDE
  • SMILES O=C1CC(C)NCC1.Cl

Description

2-Methylpiperidin-4-one hydrochloride is a bench-stable, moisture-tolerant heterocyclic amine salt featuring a ketone-functionalized piperidinone core. This structural motif integrates readily into medicinal chemistry scaffolds, offering enhanced solubility and metabolic stability in drug discovery campaigns.

Application

2-Methylpiperidin-4-one hydrochloride serves as a versatile scaffold in medicinal chemistry, enabling efficient access to substituted piperidine derivatives. Its ketone functionality facilitates nucleophilic addition, reductive amination, and conjugate addition reactions. The hydrochloride salt enhances solubility and stability, simplifying handling and purification in synthetic workflows. Functions effectively in the construction of bioactive heterocycles and API intermediates.

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   29.1
  • LogP   0.7492
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   0

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