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CS-W001157 4
Total: USD 88.00

4-Chloro-3-formylbenzonitrile

  • CAS No. 105191-41-1

  • Cat. No. CS-W022146
  • Purity≥98%
  • MDL No.MFCD11035756

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

4-Chloro-3-formylbenzonitrile|CS-W022146

Structure of 105191-41-1

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General Information

  • CAS No. 105191-41-1
  • Cat. No. CS-W022146
  • Purity ≥98%
  • MDL No. MFCD11035756
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₄ClNO
  • Molecular Weight 165.58
  • Synonym(s) 4-Chloro-3-Formyl-Benzonitrile
  • SMILES ClC1=C(C=C(C#N)C=C1)C=O

Synthesis

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    References

    • Patrick, Donald A.; Bakunov, Stanislav A.; Bakunova, Svetlana M.; Kumar, E.V.K. Suresh; Lombardy, Richard J.; Jones, Susan Kilgore; Bridges, Arlene S.; Zhirnov, Oksana; Hall, James Edwin; Wenzler, Tanja; Brun, Reto; Tidwell, Richard R. Journal of Medicinal Chemistry, 2007 , vol. 50, # 10 p. 2468 - 2485
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    References

    • Journal of Medicinal Chemistry, , vol. 50, # 10 p. 2468 - 2485
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    References

    • Journal of Medicinal Chemistry, , vol. 50, # 10 p. 2468 - 2485

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   40.86
  • LogP   2.02418
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   1

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