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1,3-Dimethyl-2-phenyl-1H-benzo[d]imidazol-3-ium iodide

  • CAS No. 3653-05-2

  • Cat. No. CS-0096829
  • Molecule weight350.20
  • Purity≥98%
  • MDL No.None

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

1,3-Dimethyl-2-phenyl-1H-benzo[d]imidazol-3-ium iodide|CS-0096829

Structure of 3653-05-2

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General Information

  • CAS No. 3653-05-2
  • Cat. No. CS-0096829
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C, protect from light, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₅H₁₅IN₂
  • Molecular Weight 350.20
  • Synonym(s) 1H-Benzimidazolium, 1,3-dimethyl-2-phenyl-, iodide
  • SMILES CN1C(C2=CC=CC=C2)=[N+](C)C3=CC=CC=C31.[I-]

Synthesis

  • Route1

    References

    • Lee, In-Sook Han; Jeoung, Eun Hee; Kreevoy, Maurice M. Journal of the American Chemical Society, 1997 , vol. 119, # 11 p. 2722 - 2728
  • Route2
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    • 1,3-Dimethyl-2-phenyl-1H-benzo[d]imidazol-3-ium iodide|CS-0096829
      3653-05-2

    References

    • Lee, In-Sook Han; Jeoung, Eun Hee; Kreevoy, Maurice M. Journal of the American Chemical Society, 1997 , vol. 119, # 11 p. 2722 - 2728
  • Route3

    References

    • Lee, In-Sook Han; Jeoung, Eun Hee; Kreevoy, Maurice M. Journal of the American Chemical Society, 1997 , vol. 119, # 11 p. 2722 - 2728

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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   8.81
  • LogP   -0.3262
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   1

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