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tert-Butyl 3-hydroxy-3-phenylazetidine-1-carboxylate

  • CAS No. 398489-25-3

  • Cat. No. CS-0069554
  • Molecule weight249.31
  • Purity≥98%
  • MDL No.MFCD09264469

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

tert-Butyl 3-hydroxy-3-phenylazetidine-1-carboxylate|CS-0069554

Structure of 398489-25-3

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General Information

  • CAS No. 398489-25-3
  • Cat. No. CS-0069554
  • Purity ≥98%
  • MDL No. MFCD09264469
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₁₉NO₃
  • Molecular Weight 249.31
  • Synonym(s) 3-HYDROXY-3-PHENYLAZETIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
  • SMILES O=C(N1CC(C2=CC=CC=C2)(O)C1)OC(C)(C)C

Synthesis

  • Route1
    • In-stock
      tert-Butyl 3-oxoazetidine-1-carboxylate|CS-D0675
      398489-26-4
    • null|null
      108-86-1
    • ~94%
    • In-stock
      tert-Butyl 3-hydroxy-3-phenylazetidine-1-carboxylate|CS-0069554
      398489-25-3

    References

    • Thaxton, Amber; Izenwasser, Sari; Wade, Dean; Stevens, Edwin D.; Mobley, David L.; Jaber, Vivian; Lomenzo, Stacey A.; Trudell, Mark L. Bioorganic and Medicinal Chemistry Letters, 2013 , vol. 23, # 15 p. 4404 - 4407
  • Route2
    • In-stock
      tert-Butyl 3-oxoazetidine-1-carboxylate|CS-D0675
      398489-26-4
    • null|null
      100-58-3
    • ~92%
    • In-stock
      tert-Butyl 3-hydroxy-3-phenylazetidine-1-carboxylate|CS-0069554
      398489-25-3

    References

    • ASTRAZENECA AB; PULMAGEN THERAPEUTICS (SYNERGY) LIMITED; DONALD, David, Keith; JENNINGS, Andrew, Stephen, Robert; RAY, Nicholas, Charles; ROUSSEL, Fabien; SUTTON, Jonathan, Mark; TISSELLI, Patrizia; WILSON, Michelle Patent: WO2011/48409 A1, 2011 ; Location in patent: Page/Page column 60-61 ; WO 2011/048409 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-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   49.77
  • LogP   2.1249
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   1

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