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3-(Piperidin-4-yloxy)benzonitrile hydrochloride

  • CAS No. 950649-07-7

  • Cat. No. CS-0237856
  • Molecule weight238.71
  • Purity≥97%
  • MDL No.None

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

3-(Piperidin-4-yloxy)benzonitrile hydrochloride|CS-0237856

Structure of 950649-07-7

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General Information

  • CAS No. 950649-07-7
  • Cat. No. CS-0237856
  • Purity ≥97%
  • MDL No. None
  • Storage Store at room temperature, keep dry and cool
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₅ClN₂O
  • Molecular Weight 238.71
  • Synonym(s) 3-(4-Piperidinyloxy)benzonitrile hydrochloride
  • SMILES C1=CC(=CC(=C1)OC2CCNCC2)C#N.Cl

Synthesis

  • Route1
    • tert-Butyl 4-(3-cyanophenoxy)piperidine-1-carboxylate|CS-1708362
      950649-06-6
    • ~%
    • In-stock
      3-(Piperidin-4-yloxy)benzonitrile hydrochloride|CS-0237856
      950649-07-7

    References

    • BOEHRINGER INGELHEIM INTERNATIONAL GMBH; BOEHRINGER INGELHEIM PHARMA GMBH and CO. KG Patent: WO2007/106705 A1, 2007 ; Location in patent: Page/Page column 100 ; WO 2007/106705 A1

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

Quality Control

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Computational Chemistry Data

  • TPSA   45.05
  • LogP   2.11088
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   2

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