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CS-W001157 4
Total: USD 88.00

1-BOC-3-trifluoromethyl-piperidin-4-one

  • CAS No. 1159983-77-3

  • Cat. No. CS-W001308
  • Purity≥97%
  • MDL No.MFCD08669340

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

1-BOC-3-trifluoromethyl-piperidin-4-one|CS-W001308

Structure of 1159983-77-3

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General Information

  • CAS No. 1159983-77-3
  • Cat. No. CS-W001308
  • Purity ≥97%
  • MDL No. MFCD08669340
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₆F₃NO₃
  • Molecular Weight 267.24
  • Synonym(s) n-boc-4-oxo-3-trifluoromethylpiperidine
  • SMILES O=C1CCN(CC1C(F)(F)F)C(=O)OC(C)(C)C

Description

1-BOC-3-trifluoromethyl-piperidin-4-one features a sterically shielded trifluoromethyl group and a bench-stable Boc-protected carbonyl, enabling direct incorporation into complex heterocyclic scaffolds. The electron-withdrawing trifluoromethyl moiety enhances reactivity in nucleophilic substitution and facilitates downstream functionalization under mild conditions.

Application

1-BOC-3-trifluoromethyl-piperidin-4-one serves as a versatile building block for the synthesis of trifluoromethylated piperidinone derivatives. The BOC group provides stability and ease of deprotection under mild acidic conditions, while the ketone functionality enables nucleophilic addition, reductive amination, and coupling reactions. Its trifluoromethyl substituent imparts enhanced metabolic stability and lipophilicity, making it valuable in medicinal chemistry campaigns targeting CNS agents and kinase inhibitors.

Safety Information

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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   46.61
  • LogP   2.3748
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   0

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