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3-Benzoimidazol-1-yl-propionitrile

  • CAS No. 4414-84-0

  • Cat. No. CS-0072243
  • Purity≥97%
  • MDL No.MFCD00817166

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

3-Benzoimidazol-1-yl-propionitrile|CS-0072243

Structure of 4414-84-0

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General Information

  • CAS No. 4414-84-0
  • Cat. No. CS-0072243
  • Purity ≥97%
  • MDL No. MFCD00817166
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₉N₃
  • Molecular Weight 171.20
  • Synonym(s) 3-(1H-benzimidazol-1-yl)propanenitrile
  • SMILES N#CCCN1C=NC2=CC=CC=C21

Synthesis

  • Route1

    References

    • Li, Lixia; Liu, Zuliang; Ling, Qilong; Xing, Xiaodong Journal of Molecular Catalysis A: Chemical, 2012 , vol. 353-354, p. 178 - 184

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-H312-H315-H319-H332-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   41.61
  • LogP   1.94998
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   2

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