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CS-W001157 4
Total: USD 88.00

3-(Piperazin-1-yl)benzo[d]isothiazole hydrochloride Ziprasidone Impurity

  • CAS No. 87691-88-1

  • Cat. No. CS-0229240
  • Purity≥98%
  • MDL No.MFCD00674131

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

3-(Piperazin-1-yl)benzo[d]isothiazole hydrochloride Ziprasidone  Impurity|CS-0229240

Structure of 87691-88-1

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General Information

  • CAS No. 87691-88-1
  • Cat. No. CS-0229240
  • Purity ≥98%
  • MDL No. MFCD00674131
  • Storage Store at room temperature, keep dry and cool
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₄ClN₃S
  • Molecular Weight None
  • Synonym(s) 1-(1,2-benzisothiazole-3-yl)piperazine hydrochloride
  • SMILES [H]Cl.C1(N2CCNCC2)=NSC3=C1C=CC=C3

Synthesis

  • Route1

    References

    • US5935960 A1, ; US 5935960 A
  • Route2
    • null|null
      110-85-0
    • 2,2'-Disulfanediyldibenzonitrile|CS-0479901
      33174-74-2
    • ~73%
    • 3-(Piperazin-1-yl)benzo[d]isothiazole hydrochloride Ziprasidone  Impurity|CS-0229240
      87691-88-1

    References

    • Organic Process Research and Development, , vol. 3, # 2 p. 126 - 130
  • Route3
    • null|null
      110-85-0
    • 2-Sulfanylbenzonitrile|CS-0209230
      34761-11-0
    • ~69%
    • 3-(Piperazin-1-yl)benzo[d]isothiazole hydrochloride Ziprasidone  Impurity|CS-0229240
      87691-88-1

    References

    • Organic Process Research and Development, , vol. 3, # 2 p. 126 - 130

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07,GHS08,GHS09
Signal Word : Warning
UN#: 3077
Class : 9
Packing Group : Ⅲ
Hazard Statements : H302-H317-H319-H361-H410
Precautionary Statements : P261-P264-P270-P272-P273-P280-P302+P352-P330-P362+P364-P391-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   28.16
  • LogP   2.1277
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   1

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