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tert-Butyl 3-amino-3-methylazetidine-1-carboxylate

  • CAS No. 1158758-77-0

  • Cat. No. CS-0042579
  • Molecule weight186.25
  • Purity≥98%
  • MDL No.MFCD12408556

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

tert-Butyl 3-amino-3-methylazetidine-1-carboxylate|CS-0042579

Structure of 1158758-77-0

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General Information

  • CAS No. 1158758-77-0
  • Cat. No. CS-0042579
  • Purity ≥98%
  • MDL No. MFCD12408556
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₈N₂O₂
  • Molecular Weight 186.25
  • Synonym(s) tert-butyl 3-aMino-3-Methyl-azetidine-1-carboxylate
  • SMILES O=C(N1CC(C)(N)C1)OC(C)(C)C

Description

tert-Butyl 3-amino-3-methylazetidine-1-carboxylate delivers a sterically hindered, bench-stable azetidine scaffold with a primary amine for downstream functionalization. This cyclic amine derivative integrates readily into peptide-like architectures and bioactive molecule design, offering enhanced metabolic stability and solubility in synthetic workflows.

Application

tert-Butyl 3-amino-3-methylazetidine-1-carboxylate serves as a valuable building block in medicinal chemistry, enabling the efficient construction of nitrogen-containing heterocycles. The azetidine core provides conformational rigidity and enhanced metabolic stability, while the tert-butoxycarbonyl (Boc) group offers excellent protection for the amine during multistep synthesis. Its functional group tolerance facilitates diverse transformations, including coupling reactions and cyclizations, making it a practical choice for scaffold diversification in API 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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   55.56
  • LogP   0.9545
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   0

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