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tert-Butyl 2-methylaziridine-1-carboxylate

  • CAS No. 129319-71-7

  • Cat. No. CS-B1213
  • Molecule weight157.21
  • Purity≥96%
  • MDL No.MFCD22665811

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

tert-Butyl 2-methylaziridine-1-carboxylate|CS-B1213

Structure of 129319-71-7

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General Information

  • CAS No. 129319-71-7
  • Cat. No. CS-B1213
  • Purity ≥96%
  • MDL No. MFCD22665811
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₁₅NO₂
  • Molecular Weight 157.21
  • Synonym(s) N-(t-butyloxycarbonyl)-2-methylaziridine
  • SMILES O=C(N1C(C)C1)OC(C)(C)C

Description

tert-Butyl 2-methylaziridine-1-carboxylate is a bench-stable, moisture-tolerant aziridine derivative featuring a sterically shielded tert-butyl ester group. This configuration enhances stability while preserving reactivity for ring-opening transformations. The methyl-substituted aziridine core enables selective functionalization in synthetic sequences, particularly in the construction of nitrogen-containing heterocycles and chiral building blocks.

Application

tert-Butyl 2-methylaziridine-1-carboxylate serves as a versatile, bench-stable building block for the synthesis of nitrogen-containing heterocycles and bioactive molecules. Its strained aziridine ring enables regioselective ring-opening reactions with nucleophiles under mild conditions, while the tert-butoxycarbonyl (Boc) group provides orthogonal protection. The molecule exhibits good functional group tolerance and facilitates straightforward purification, making it well-suited for iterative synthesis in medicinal chemistry and process development workflows.

Safety Information

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GHS Pictogram :
GHS No : GHS02,GHS07
Signal Word : Danger
UN#: 1993
Class : 3
Packing Group : Ⅱ
Hazard Statements : H225-H315-H319
Precautionary Statements : P210-P233-P240-P241-P242-P243-P264-P280-P362+P364-P370+P378-P501

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Computational Chemistry Data

  • TPSA   29.31
  • LogP   1.6256
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   0

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