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tert-Butyl ((S)-1-amino-3-((R)-tetrahydro-2H-pyran-3-yl)propan-2-yl)(methyl)carbamate

  • CAS No. 942145-27-9

  • Cat. No. CS-B0365
  • Purity≥95%
  • MDL No.MFCD13184739

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

tert-Butyl ((S)-1-amino-3-((R)-tetrahydro-2H-pyran-3-yl)propan-2-yl)(methyl)carbamate|CS-B0365

Structure of 942145-27-9

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General Information

  • CAS No. 942145-27-9
  • Cat. No. CS-B0365
  • Purity ≥95%
  • MDL No. MFCD13184739
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₂₈N₂O₃
  • Molecular Weight 272.39
  • Synonym(s) None
  • SMILES O=C(OC(C)(C)C)N(C)[C@H](CN)C[C@@H]1COCCC1

Synthesis

  • Route1
    • null|null
      1013937-85-3
    • ~92%
    • In-stock
      tert-Butyl ((S)-1-amino-3-((R)-tetrahydro-2H-pyran-3-yl)propan-2-yl)(methyl)carbamate|CS-B0365
      942145-27-9

    References

    • VITAE PHARMACEUTICALS, INC. Patent: WO2008/156817 A2, 2008 ; Location in patent: Page/Page column 94; 99 ; WO 2008/156817 A2
  • Route2
    • tert-Butyl ((S)-1-azido-3-((R)-tetrahydro-2H-pyran-3-yl)propan-2-yl)(methyl)carbamate|CS-B0364
      942145-26-8
    • ~93%
    • In-stock
      tert-Butyl ((S)-1-amino-3-((R)-tetrahydro-2H-pyran-3-yl)propan-2-yl)(methyl)carbamate|CS-B0365
      942145-27-9

    References

    • Jia, Lanqi; Simpson, Robert D.; Yuan, Jing; Xu, Zhenrong; Zhao, Wei; Cacatian, Salvacion; Tice, Colin M.; Guo, Joan; Ishchenko, Alexey; Singh, Suresh B.; Wu, Zhongren; McKeever, Brian M.; Bukhtiyarov, Yuri; Johnson, Judith A.; Doe, Christopher P.; Harrison, Richard K.; McGeehan, Gerard M.; Dillard, Lawrence W.; Baldwin, John J.; Claremon, David A. ACS Medicinal Chemistry Letters, 2011 , vol. 2, # 10 p. 747 - 751
  • Route3
    • null|null
      1093865-03-2
    • ~98%
    • In-stock
      tert-Butyl ((S)-1-amino-3-((R)-tetrahydro-2H-pyran-3-yl)propan-2-yl)(methyl)carbamate|CS-B0365
      942145-27-9

    References

    • VITAE PHARMACEUTICALS, INC. Patent: WO2009/154766 A1, 2009 ; Location in patent: Page/Page column 47 ; WO 2009/154766 A1

Safety Information

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GHS Pictogram : N/A
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Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

Quality Control

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Computational Chemistry Data

  • TPSA   64.79
  • LogP   1.9973
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   4

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