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CS-W001157 4
Total: USD 88.00

Quinuclidine-3-carboxylic acid hydrochloride

  • CAS No. 6238-34-2

  • Cat. No. CS-0454406
  • Molecule weight191.66
  • Purity≥98%
  • MDL No.None

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

Quinuclidine-3-carboxylic acid hydrochloride|CS-0454406

Structure of 6238-34-2

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General Information

  • CAS No. 6238-34-2
  • Cat. No. CS-0454406
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₁₄ClNO₂
  • Molecular Weight 191.66
  • Synonym(s) (1s,4s)-quinuclidine-3-carboxylic acid hydrochloride
  • SMILES C1CN2CCC1C(C2)C(=O)O.Cl

Synthesis

  • Route1
    • Quinuclidine-3-carbonitrile|CS-0453177
      51627-76-0
    • ~%
    • Quinuclidine-3-carboxylic acid hydrochloride|CS-0454406
      6238-34-2

    References

    • VERTEX PHARMACEUTICALS INCORPORATED; EVERITT, Simon; KNEGTEL, Ronald; MORTIMORE, Michael; RUTHERFORD, Alistair Patent: WO2013/43960 A1, 2013 ; Location in patent: Paragraph 00159 ;
  • Route2
    • Ethyl quinuclidine-3-carboxylate|CS-0317466
      6238-33-1
    • ~80%
    • Quinuclidine-3-carboxylic acid hydrochloride|CS-0454406
      6238-34-2

    References

    • Zhichareva, G. P.; Yakhontov, L. N.; Marshalkin, M. F.; Turchin, K. F.; Kuleshova, E. F.; Sheinker, Yu. N. Pharmaceutical Chemistry Journal, 1991 , vol. 25, # 1 p. 22 - 26 Khimiko-Farmatsevticheskii Zhurnal, 1991 , vol. 25, # 1 p. 32 - 36
  • Route3
    • null|null
      38206-86-9
    • ~%
    • Quinuclidine-3-carboxylic acid hydrochloride|CS-0454406
      6238-34-2

    References

    • Saunders, John; Cassidy, Mark; Freedman, Stephen B.; Harley, Elizabeth A.; Iversen, Leslie L.; et al. Journal of Medicinal Chemistry, 1990 , vol. 33, # 4 p. 1128 - 1138

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   40.54
  • LogP   0.8346
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   1

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