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CS-W001157 4
Total: USD 88.00

5-Amino-1-isopropyl-1h-pyrazole-4-carbonitrile

  • CAS No. 21254-23-9

  • Cat. No. CS-0274453
  • Purity≥98%
  • MDL No.None

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

5-Amino-1-isopropyl-1h-pyrazole-4-carbonitrile|CS-0274453

Structure of 21254-23-9

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General Information

  • CAS No. 21254-23-9
  • Cat. No. CS-0274453
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₁₀N₄
  • Molecular Weight 150.18
  • Synonym(s) 1H-Pyrazole-4-carbonitrile,5-amino-1-(1-methylethyl)-(9CI)
  • SMILES CC(C)N1C(=C(C#N)C=N1)N

Synthesis

  • Route1
    • Isopropylhydrazine dihydrochloride|CS-0580294
      70629-60-6
    • 2-(Ethoxymethylene)propanedinitrile|CS-0653697
      123-06-8
    • ~80%
    • In-stock
      5-Amino-1-isopropyl-1h-pyrazole-4-carbonitrile|CS-0274453
      21254-23-9

    References

    • Pfizer Inc. Patent: US2010/190771 A1, 2010 ; Location in patent: Page/Page column 17 ;
  • Route2
    • null|null
      2257-52-5
    • 2-(Ethoxymethylene)propanedinitrile|CS-0653697
      123-06-8
    • ~%
    • In-stock
      5-Amino-1-isopropyl-1h-pyrazole-4-carbonitrile|CS-0274453
      21254-23-9

    References

    • Schmidt et al. Helvetica Chimica Acta, 1958 , vol. 41, p. 1052,1056 Helvetica Chimica Acta, 1959 , vol. 42, p. 349,354

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301-H311-H331
Precautionary Statements : P264-P270-P330-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   67.63
  • LogP   0.91788
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   1

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