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tert-Butyl 3-(aminomethyl)-3-methylazetidine-1-carboxylate

  • CAS No. 1158758-85-0

  • Cat. No. CS-0035995
  • Molecule weight200.28
  • Purity≥97%
  • MDL No.MFCD12408560

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

tert-Butyl 3-(aminomethyl)-3-methylazetidine-1-carboxylate|CS-0035995

Structure of 1158758-85-0

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General Information

  • CAS No. 1158758-85-0
  • Cat. No. CS-0035995
  • Purity ≥97%
  • MDL No. MFCD12408560
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₂₀N₂O₂
  • Molecular Weight 200.28
  • Synonym(s) 3-(Aminomethyl)-3-methyl-1-azetidinecarboxylic acid 1,1-dimethylethyl ester
  • SMILES CC(C)(C)OC(=O)N1CC(C)(CN)C1

Description

tert-Butyl 3-(aminomethyl)-3-methylazetidine-1-carboxylate delivers a sterically hindered, bench-stable azetidine scaffold with a pendant primary amine. This configuration enables direct functionalization in late-stage diversification, particularly useful in medicinal chemistry for constructing constrained bioactive architectures. The tert-butyl ester group facilitates purification and protection during synthesis.

Application

tert-Butyl 3-(aminomethyl)-3-methylazetidine-1-carboxylate serves as a versatile building block for constructing nitrogen-containing heterocycles, enabling efficient access to azetidine-based scaffolds. Its tert-butyl carbamate group provides excellent stability and ease of removal under mild acidic conditions, while the primary amine functionality supports diverse functionalization. The molecule exhibits robust compatibility with standard coupling reactions and demonstrates favorable handling characteristics in multi-step synthetic sequences.

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+P364-P405-P501

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Computational Chemistry Data

  • TPSA   55.56
  • LogP   1.2021
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   1

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