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CS-W001157 4
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4-Amino-1-methyl-1h-pyrazole-3-carbonitrile

  • CAS No. 1201935-84-3

  • Cat. No. CS-0044899
  • Purity≥98%
  • MDL No.MFCD19215684

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

4-Amino-1-methyl-1h-pyrazole-3-carbonitrile|CS-0044899

Structure of 1201935-84-3

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General Information

  • CAS No. 1201935-84-3
  • Cat. No. CS-0044899
  • Purity ≥98%
  • MDL No. MFCD19215684
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₅H₆N₄
  • Molecular Weight 122.13
  • Synonym(s) 4-amino-1-methylpyrazole-3-carbonitrile
  • SMILES N#CC1=NN(C)C=C1N

Description

4-Amino-1-methyl-1H-pyrazole-3-carbonitrile features a conjugated pyrazole core with complementary electron-donating and withdrawing groups, enabling efficient integration into heterocyclic scaffolds. The amino and nitrile functionalities facilitate downstream derivatization in medicinal chemistry and materials science applications.

Application

4-Amino-1-methyl-1H-pyrazole-3-carbonitrile serves as a versatile heterocyclic building block in medicinal chemistry, enabling efficient access to pyrazole-based scaffolds. Its dual functional groups—amine and nitrile—facilitate diverse downstream transformations, including amidation, cyclization, and metal-catalyzed coupling reactions. The compound exhibits good bench stability and is readily purified by recrystallization, making it well-suited for scalable synthesis and high-throughput screening campaigns.

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-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   67.63
  • LogP   -0.12602
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   0

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