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Methyl (1S,3R)-3-{[(tert-butoxy)carbonyl]amino}cyclopentane-1-carboxylate

  • CAS No. 554451-12-6

  • Cat. No. CS-0058056
  • Purity≥98%
  • MDL No.None

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

Methyl (1S,3R)-3-{[(tert-butoxy)carbonyl]amino}cyclopentane-1-carboxylate|CS-0058056

Structure of 554451-12-6

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General Information

  • CAS No. 554451-12-6
  • Cat. No. CS-0058056
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₂₁NO₄
  • Molecular Weight 243.30
  • Synonym(s) (1S,3R)-methyl 3-[(tert-butoxycarbonyl)amino]cyclopentanecarboxylate
  • SMILES O=C([C@@H]1C[C@H](NC(OC(C)(C)C)=O)CC1)OC

Synthesis

  • Route1

    References

    • PFIZER LIMITED Patent: WO2009/153720 A1, 2009 ; Location in patent: Page/Page column 249 ; WO 2009/153720 A1
  • Route2

    References

    • TAISHO PHARMACEUTICAL CO., LTD.; ARENA PHARMACEUTICALS, INC. Patent: WO2006/35967 A1, 2006 ; Location in patent: Page/Page column 100 ; WO 2006/035967 A1
  • Route3

    References

    • Madar, David J.; Djuric, Stevan W.; Michmerhuizen, Melissa J.; Kopecka, Hana A.; Li, Xiaofeng; Longenecker, Kenton L.; Pei, Zhonghua; Pireh, Daisy; Sham, Hing L.; Stewart, Kent D.; Szczepankiewicz, Bruce G.; Wiedeman, Paul E.; Yong, Hong Patent: US2005/215784 A1, 2005 ; US 20050215784 A1

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-H312-H332
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P501

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Computational Chemistry Data

  • TPSA   64.63
  • LogP   1.8528
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   2

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