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tert-Butyl 6-hydroxy-2-azaspiro[3.4]octane-2-carboxylate

  • CAS No. 1363381-95-6

  • Cat. No. CS-0042481
  • Purity≥95%
  • MDL No.MFCD22415223

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

tert-Butyl 6-hydroxy-2-azaspiro[3.4]octane-2-carboxylate|CS-0042481

Structure of 1363381-95-6

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General Information

  • CAS No. 1363381-95-6
  • Cat. No. CS-0042481
  • Purity ≥95%
  • MDL No. MFCD22415223
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₂₁NO₃
  • Molecular Weight 227.30
  • Synonym(s) None
  • SMILES O=C(OC(C)(C)C)N1CC2(C1)CCC(O)C2

Description

tert-Butyl 6-hydroxy-2-azaspiro[3.4]octane-2-carboxylate features a rigid spirocyclic scaffold with a hydroxyl group at the C6 position and a protected amine at the bridgehead nitrogen. This configuration enables precise stereochemical control in complex molecule synthesis, particularly in medicinal chemistry applications requiring constrained amine-containing frameworks. The tert-butyl ester facilitates convenient deprotection under mild acidic conditions, streamlining downstream functionalization.

Application

tert-Butyl 6-hydroxy-2-azaspiro[3.4]octane-2-carboxylate serves as a versatile spirocyclic scaffold for medicinal chemistry, enabling the construction of complex nitrogen-containing heterocycles. The pendant hydroxyl group offers direct handle for derivatization, while the tert-butyl ester provides stability and convenient deprotection under mild acidic conditions. Its rigid, three-dimensional architecture supports stereocontrolled synthesis and is well-suited for applications in target-oriented drug discovery and macrocycle development.

Safety Information

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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-P405-P501

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Computational Chemistry Data

  • TPSA   49.77
  • LogP   1.7683
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   0

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