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tert-Butyl 3-(4-(methoxycarbonyl)phenyl)azetidine-1-carboxylate

  • CAS No. 1240970-70-0

  • Cat. No. CS-0090621
  • Molecule weight291.34
  • Purity≥97%
  • MDL No.MFCD18074042

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

tert-Butyl 3-(4-(methoxycarbonyl)phenyl)azetidine-1-carboxylate|CS-0090621

Structure of 1240970-70-0

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General Information

  • CAS No. 1240970-70-0
  • Cat. No. CS-0090621
  • Purity ≥97%
  • MDL No. MFCD18074042
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₆H₂₁NO₄
  • Molecular Weight 291.34
  • Synonym(s) TERT-BUTYL 3-(4-(METHOXYCARBONYL)PHENYL)AZETIDINE-1-CARBOXYLATE(WXC07258)
  • SMILES O=C(N1CC(C2=CC=C(C(OC)=O)C=C2)C1)OC(C)(C)C

Description

tert-Butyl 3-(4-(methoxycarbonyl)phenyl)azetidine-1-carboxylate features a strained azetidine core bearing a para-methoxycarbonyl-substituted phenyl group, offering enhanced metabolic stability and favorable solubility. This bench-stable derivative integrates readily into synthetic sequences for bioactive molecule construction.

Application

tert-Butyl 3-(4-(methoxycarbonyl)phenyl)azetidine-1-carboxylate serves as a versatile building block for the synthesis of bioactive azetidine-containing scaffolds. The pendant phenyl group enables efficient Suzuki-Miyaura coupling, while the tert-butyl ester facilitates selective deprotection under mild acidic conditions. Its bench-stable nature and compatibility with diverse reaction conditions make it ideal for iterative late-stage functionalization in medicinal chemistry campaigns.

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   55.84
  • LogP   2.8075
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   2

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