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CS-W001157 4
Total: USD 88.00

3-(1H-pyrrol-1-yl)benzonitrile

  • CAS No. 175134-98-2

  • Cat. No. CS-0320820
  • Purity95+%
  • MDL No.None

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

3-(1H-pyrrol-1-yl)benzonitrile|CS-0320820

Structure of 175134-98-2

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General Information

  • CAS No. 175134-98-2
  • Cat. No. CS-0320820
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₈N₂
  • Molecular Weight 168.19
  • Synonym(s) 1-(3-cyanophenyl)pyrrole
  • SMILES C1=CN(C=C1)C2=CC=CC(=C2)C#N

Synthesis

  • Route1
    • null|null
      696-59-3
    • null|null
      2237-30-1
    • ~93%
    • 3-(1H-pyrrol-1-yl)benzonitrile|CS-0320820
      175134-98-2

    References

    • Journal of Medicinal Chemistry, , vol. 44, # 4 p. 566 - 578

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H225
Precautionary Statements : P210-P233-P240-P241-P242-P243-P280-P370+P378-P501

Quality Control

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Computational Chemistry Data

  • TPSA   28.72
  • LogP   2.34898
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   1

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