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CS-W001157 4
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1-(tert-Butyl)azetidin-3-ol

  • CAS No. 13156-04-2

  • Cat. No. CS-0044513
  • Purity≥98%
  • MDL No.MFCD02323245

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

1-(tert-Butyl)azetidin-3-ol|CS-0044513

Structure of 13156-04-2

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General Information

  • CAS No. 13156-04-2
  • Cat. No. CS-0044513
  • Purity ≥98%
  • MDL No. MFCD02323245
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₁₅NO
  • Molecular Weight 129.20
  • Synonym(s) 1-tert-Butyl-3-azetidinol
  • SMILES OC1CN(C(C)(C)C)C1

Description

1-(tert-Butyl)azetidin-3-ol features a strained azetidine ring bearing a tertiary butyl group and a hydroxyl functionality, offering enhanced stability and solubility in polar media. This scaffold integrates readily into bioactive molecules, providing a rigid, electron-rich core for medicinal chemistry applications.

Application

1-(tert-Butyl)azetidin-3-ol serves as a valuable chiral building block in medicinal chemistry, offering a sterically hindered azetidine core with a pendant hydroxyl group. The tert-butyl substituent enhances metabolic stability and modulates physicochemical properties. It functions reliably in nucleophilic substitution and coupling reactions, enabling access to diverse heterocyclic scaffolds. Bench-stable and amenable to purification, it facilitates efficient synthesis of bioactive molecules and API intermediates.

Synthesis

  • Route1
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      75-64-9
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      106-89-8
    • ~%
    • In-stock
      1-(tert-Butyl)azetidin-3-ol|CS-0044513
      13156-04-2

    References

    • WO2010/59393 A1, ; Page/Page column 160 ; WO 2010/059393 A1
  • Route2

    References

    • Oh, Chang Ho; Rhim, Chul Yun; You, Choong Ho; Cho, Jin Rai Synthetic Communications, 2003 , vol. 33, # 24 p. 4297 - 4302
  • Route3
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      111043-41-5
    • ~%
    • In-stock
      1-(tert-Butyl)azetidin-3-ol|CS-0044513
      13156-04-2

    References

    • Journal of Heterocyclic Chemistry, , vol. 24, p. 255 - 259

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS02
Signal Word : Danger
UN#: 1325
Class : 4.1
Packing Group : Ⅲ
Hazard Statements : H226
Precautionary Statements : P210-P233-P240-P241-P242-P243-P280-P303+P361+P353-P370+P378-P403+P235-P501

Quality Control

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Computational Chemistry Data

  • TPSA   23.47
  • LogP   0.4614
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   0

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