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CS-W001157 4
Total: USD 88.00

3-(Piperidin-1-yl)benzoic acid

  • CAS No. 77940-94-4

  • Cat. No. CS-0217388
  • Purity95+%
  • MDL No.MFCD06659081

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

3-(Piperidin-1-yl)benzoic acid|CS-0217388

Structure of 77940-94-4

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General Information

  • CAS No. 77940-94-4
  • Cat. No. CS-0217388
  • Purity 95+%
  • MDL No. MFCD06659081
  • Storage RT, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₅NO₂
  • Molecular Weight 205.25
  • Synonym(s) 3-Piperidinobenzoic acid
  • SMILES C1CCN(CC1)C2=CC=CC(=C2)C(=O)O

Synthesis

  • Route1
    • Methyl 3-(piperidin-1-yl)benzoate|CS-0667778
      57489-59-5
    • ~91%
    • In-stock
      3-(Piperidin-1-yl)benzoic acid|CS-0217388
      77940-94-4

    References

    • Journal of Medicinal Chemistry, , vol. 40, # 3 p. 331 - 341
  • Route2

    References

    • Journal of Medicinal Chemistry, , vol. 40, # 3 p. 331 - 341
  • Route3

    References

    • Journal of Medicinal Chemistry, , vol. 40, # 3 p. 331 - 341

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-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   40.54
  • LogP   2.3751
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   2

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