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Methyl 4-(piperidin-4-ylmethyl)benzoate hydrochloride

  • CAS No. 333986-70-2

  • Cat. No. CS-0038480
  • Purity≥98%
  • MDL No.MFCD02179177

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

Methyl 4-(piperidin-4-ylmethyl)benzoate hydrochloride|CS-0038480

Structure of 333986-70-2

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General Information

  • CAS No. 333986-70-2
  • Cat. No. CS-0038480
  • Purity ≥98%
  • MDL No. MFCD02179177
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₂₀ClNO₂
  • Molecular Weight 269.77
  • Synonym(s) None
  • SMILES Cl.O=C(OC)C1=CC=C(C=C1)CC2CCNCC2

Description

Methyl 4-(piperidin-4-ylmethyl)benzoate hydrochloride features a benzoyl core linked to a piperidine-containing side chain, delivering enhanced solubility and stability under standard conditions. This bench-stable derivative integrates readily into medicinal chemistry campaigns requiring basic nitrogen handles for downstream functionalization.

Application

Methyl 4-(piperidin-4-ylmethyl)benzoate hydrochloride serves as a versatile building block in medicinal chemistry, enabling the construction of bioactive heterocyclic scaffolds. The piperidinylmethyl moiety provides a flexible amine handle for further derivatization, while the ester group supports standard transformations such as hydrolysis or nucleophilic substitution. Its salt form enhances solubility and stability, facilitating handling and purification in multi-step synthesis.

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   38.33
  • LogP   2.4371
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   3

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