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CS-W001157 4
Total: USD 88.00

1-Benzyl-4-(carboxymethyl)piperidine-4-carboxylic acid

  • CAS No. 40117-92-8

  • Cat. No. CS-0465448
  • Purity≥98%
  • MDL No.MFCD00101327

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

1-Benzyl-4-(carboxymethyl)piperidine-4-carboxylic acid|CS-0465448

Structure of 40117-92-8

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General Information

  • CAS No. 40117-92-8
  • Cat. No. CS-0465448
  • Purity ≥98%
  • MDL No. MFCD00101327
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₅H₁₉NO₄
  • Molecular Weight 277.32
  • Synonym(s) 1-BENZYL-4-CARBOXYMETHYL-PIPERIDINE-4-CARBOXYLIC ACID
  • SMILES C1=CC=C(C=C1)CN2CCC(CC2)(CC(=O)O)C(=O)O

Synthesis

  • Route1
    • null|null
      3612-20-2
    • ~%
    • 1-Benzyl-4-(carboxymethyl)piperidine-4-carboxylic acid|CS-0465448
      40117-92-8

    References

    • Mehrotra, Mukund M.; Heath, Julie A.; Rose, Jack W.; Smyth, Mark S.; Seroogy, Joseph; Volkots, Deborah L.; Ruhter, Gerd; Schotten, Theo; Alaimo, Lisa; Park, Gary; Pandey, Anjali; Scarborough, Robert M. Bioorganic and Medicinal Chemistry Letters, 2002 , vol. 12, # 7 p. 1103 - 1107
  • Route2
    • Ethyl 2-(1-benzylpiperidin-4-ylidene)-2-cyanoacetate|CS-0328703
      1463-52-1
    • ~%
    • 1-Benzyl-4-(carboxymethyl)piperidine-4-carboxylic acid|CS-0465448
      40117-92-8

    References

    • Mehrotra, Mukund M.; Heath, Julie A.; Rose, Jack W.; Smyth, Mark S.; Seroogy, Joseph; Volkots, Deborah L.; Ruhter, Gerd; Schotten, Theo; Alaimo, Lisa; Park, Gary; Pandey, Anjali; Scarborough, Robert M. Bioorganic and Medicinal Chemistry Letters, 2002 , vol. 12, # 7 p. 1103 - 1107
  • Route3
    • 1-Benzyl-4-(cyanomethyl)piperidine-4-carbonitrile|CS-M1533
      86945-27-9
    • ~%
    • 1-Benzyl-4-(carboxymethyl)piperidine-4-carboxylic acid|CS-0465448
      40117-92-8

    References

    • Mehrotra, Mukund M.; Heath, Julie A.; Rose, Jack W.; Smyth, Mark S.; Seroogy, Joseph; Volkots, Deborah L.; Ruhter, Gerd; Schotten, Theo; Alaimo, Lisa; Park, Gary; Pandey, Anjali; Scarborough, Robert M. Bioorganic and Medicinal Chemistry Letters, 2002 , vol. 12, # 7 p. 1103 - 1107

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   77.84
  • LogP   1.8281
  • H_Acceptors   3
  • H_Donors   2
  • Rotatable_Bonds   5

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