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CS-W001157 4
Total: USD 88.00

4-(Benzyloxycarbonylamino)bicyclo[2.2.2]octane-1-carboxylic acid

  • CAS No. 444344-91-6

  • Cat. No. CS-0051072
  • Purity≥98%
  • MDL No.MFCD18827452

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

4-(Benzyloxycarbonylamino)bicyclo[2.2.2]octane-1-carboxylic acid|CS-0051072

Structure of 444344-91-6

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General Information

  • CAS No. 444344-91-6
  • Cat. No. CS-0051072
  • Purity ≥98%
  • MDL No. MFCD18827452
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₇H₂₁NO₄
  • Molecular Weight 303.36
  • Synonym(s) None
  • SMILES O=C(OCC=1C=CC=CC1)NC23CCC(C(=O)O)(CC2)CC3

Synthesis

  • Route1
    • Methyl 4-{[(benzyloxy)carbonyl]amino}bicyclo[2.2.2]octane-1-carboxylate|CS-0012665
      862501-91-5
    • ~%
    • In-stock
      4-(Benzyloxycarbonylamino)bicyclo[2.2.2]octane-1-carboxylic acid|CS-0051072
      444344-91-6

    References

    • KYORIN PHARMACEUTICAL CO., LTD. Patent: EP1717225 A1, 2006 ; Location in patent: Page/Page column 12 ;
  • Route2
    • Ethyl 4-(((benzyloxy)carbonyl)amino)bicyclo[2.2.2]octane-1-carboxylate|CS-0665478
      444344-90-5
    • ~86%
    • In-stock
      4-(Benzyloxycarbonylamino)bicyclo[2.2.2]octane-1-carboxylic acid|CS-0051072
      444344-91-6

    References

    • Reynolds, Robert C; Johnson, Cheryl A; Piper, James R; Sirotnak, Frances M European Journal of Medicinal Chemistry, 2001 , vol. 36, # 3 p. 237 - 242

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

Quality Control

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Computational Chemistry Data

  • TPSA   75.63
  • LogP   3.0904
  • H_Acceptors   3
  • H_Donors   2
  • Rotatable_Bonds   4

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