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CS-W001157 4
Total: USD 88.00

1-(2-Chloroethyl)-1H-1,2,4-triazole

  • CAS No. 3236-66-6

  • Cat. No. CS-0170823
  • Molecule weight131.56
  • Purity≥97%
  • MDL No.None

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

1-(2-Chloroethyl)-1H-1,2,4-triazole|CS-0170823

Structure of 3236-66-6

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General Information

  • CAS No. 3236-66-6
  • Cat. No. CS-0170823
  • Purity ≥97%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₄H₆ClN₃
  • Molecular Weight 131.56
  • Synonym(s) None
  • SMILES C(CN1C=NC=N1)Cl

Synthesis

  • Route1

    References

    • Kuehler, Thomas C.; Swanson, Marianne; Christenson, Beritte; Klintenberg, Ann-Charlotte; Lamm, Bo; Faegerhag, Jonas; Gatti, Roberto; Oelwegard-Halvarsson, Maria; Shcherbuchin, Vladimir; Elebring, Thomas; Sjoestroem, Jan-Erik Journal of Medicinal Chemistry, 2002 , vol. 45, # 19 p. 4282 - 4299
  • Route2

    References

    • US2003/199459 A1, ;
  • Route3
    • In-stock
      1,2,4-Triazole|CS-D1150
      288-88-0
    • null|null
      106-93-4
    • ~%
    • In-stock
      1-(2-Chloroethyl)-1H-1,2,4-triazole|CS-0170823
      3236-66-6

    References

    • Journal of Medicinal Chemistry, , vol. 34, # 2 p. 827 - 841

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   30.71
  • LogP   0.5169
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   2

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