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CS-W001157 4
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2-Isopropylthiazole-4-carbaldehyde

  • CAS No. 133047-46-8

  • Cat. No. CS-0043944
  • Purity≥98%
  • MDL No.MFCD06660125

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

2-Isopropylthiazole-4-carbaldehyde|CS-0043944

Structure of 133047-46-8

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General Information

  • CAS No. 133047-46-8
  • Cat. No. CS-0043944
  • Purity ≥98%
  • MDL No. MFCD06660125
  • Storage -20°C, sealed storage, away from moisture
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₉NOS
  • Molecular Weight 155.22
  • Synonym(s) 4-Thiazolecarboxaldehyde, 2-(1-methylethyl)- (9CI)
  • SMILES O=CC1=CSC(C(C)C)=N1

Description

2-Isopropylthiazole-4-carbaldehyde delivers a sterically hindered thiazole scaffold bearing a reactive aldehyde group, enabling direct coupling in multistep synthesis. This bench-stable heterocycle integrates readily into bioactive molecule frameworks where lipophilic character and regioselective functionalization are critical.

Application

2-Isopropylthiazole-4-carbaldehyde serves as a versatile building block in medicinal chemistry, enabling efficient access to thiazole-based pharmacophores. Its aldehyde functionality facilitates nucleophilic additions and condensation reactions, while the isopropyl group enhances metabolic stability and lipophilicity. The molecule exhibits good bench stability and compatibility with standard synthetic workflows, making it suitable for modular library synthesis and structure-activity studies.

Synthesis

  • Route1

    References

    • Hagen; Domagala; Gajda; Lovdahl; Tait; Wise; Holler; Hupe; Nouhan; Urumov; Zeikus; Lunney; Pavlovsky; Gracheck; Saunders; VanderRoest; Brodfuehrer Journal of Medicinal Chemistry, 2001 , vol. 44, # 14 p. 2319 - 2332
  • Route2

    References

    • Bruenjes, Marco; Sourkouni-Argirusi, Georgia; Kirschning, Andreas Advanced Synthesis and Catalysis, 2003 , vol. 345, # 5 p. 635 - 642

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302
Precautionary Statements : P264-P270-P330-P501

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Computational Chemistry Data

  • TPSA   29.96
  • LogP   2.079
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   2

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