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CS-W001157 4
Total: USD 88.00

1-Isopropyl-1H-pyrazole-4-carbaldehyde

  • CAS No. 313735-67-0

  • Cat. No. CS-W004220
  • Purity≥97%
  • MDL No.MFCD06260724

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

1-Isopropyl-1H-pyrazole-4-carbaldehyde|CS-W004220

Structure of 313735-67-0

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General Information

  • CAS No. 313735-67-0
  • Cat. No. CS-W004220
  • Purity ≥97%
  • MDL No. MFCD06260724
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₁₀N₂O
  • Molecular Weight 138.17
  • Synonym(s) 1-(propan-2-yl)-1H-pyrazole-4-carbaldehyde
  • SMILES O=Cc1cnn(c1)C(C)C

Description

1-Isopropyl-1H-pyrazole-4-carbaldehyde features a pyrazole core bearing a para-aldehyde group and a sterically hindered isopropyl substituent. This combination imparts enhanced stability and favorable solubility in organic solvents, enabling efficient incorporation into heterocyclic scaffolds. The aldehyde functionality facilitates direct coupling in multistep synthesis workflows.

Application

1-Isopropyl-1H-pyrazole-4-carbaldehyde serves as a versatile building block in medicinal chemistry, enabling efficient construction of pyrazole-based heterocycles. Its aldehyde functionality facilitates nucleophilic addition, reductive amination, and condensation reactions under standard conditions. The isopropyl group enhances solubility and metabolic stability, while the scaffold exhibits bench stability and compatibility with diverse functional groups, supporting scalable synthesis and downstream derivatization.

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-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   34.89
  • LogP   1.2765
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   2

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