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CS-W001157 4
Total: USD 88.00

4-(tert-Butyl)-1H-imidazole-5-carbaldehyde

  • CAS No. 714273-83-3

  • Cat. No. CS-0085749
  • Purity≥95%
  • MDL No.MFCD14583325

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

4-(tert-Butyl)-1H-imidazole-5-carbaldehyde|CS-0085749

Structure of 714273-83-3

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General Information

  • CAS No. 714273-83-3
  • Cat. No. CS-0085749
  • Purity ≥95%
  • MDL No. MFCD14583325
  • Storage -20°C, sealed storage, away from moisture
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₁₂N₂O
  • Molecular Weight 152.19
  • Synonym(s) 5-tert-Butyl-1H-imidazole-4-carbaldehyde
  • SMILES O=CC1=C(C(C)(C)C)N=CN1

Description

4-(tert-Butyl)-1H-imidazole-5-carbaldehyde features a sterically hindered tert-butyl group that enhances stability and solubility in organic media. The aldehyde functionality enables direct coupling in multistep syntheses, while the imidazole core provides a robust scaffold for bioactive molecule design. This compound integrates seamlessly into pharmaceutical intermediates and functional materials.

Application

4-(tert-Butyl)-1H-imidazole-5-carbaldehyde serves as a versatile building block in medicinal and process chemistry, enabling the synthesis of imidazole-based scaffolds through standard aldehyde transformations. Its tert-butyl group enhances steric stability and solubility, while the aldehyde functionality facilitates reductive amination, Grignard additions, and coupling reactions with broad functional group tolerance. The molecule exhibits excellent bench stability and ease of purification, making it well-suited for high-throughput screening and API intermediate 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   45.75
  • LogP   1.5197
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   1

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