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CS-W001157 4
Total: USD 88.00

4-Ethynylbenzamide

  • CAS No. 90347-86-7

  • Cat. No. CS-0611493
  • Purity≥98%
  • MDL No.None

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

4-Ethynylbenzamide|CS-0611493

Structure of 90347-86-7

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General Information

  • CAS No. 90347-86-7
  • Cat. No. CS-0611493
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₇NO
  • Molecular Weight 145.16
  • Synonym(s) Benzamide, 4-ethynyl- (9CI)
  • SMILES O=C(N)C1=CC=C(C#C)C=C1

Synthesis

  • Route1
    • null|null
      863640-43-1
    • ~95%
    • 4-Ethynylbenzamide|CS-0611493
      90347-86-7

    References

    • Nguyen, Ngoc-Ha; Apriletti, James W.; Baxter, John D.; Scanlan, Thomas S. Journal of the American Chemical Society, 2005 , vol. 127, # 13 p. 4599 - 4608
  • Route2

    References

    • Nguyen, Ngoc-Ha; Apriletti, James W.; Baxter, John D.; Scanlan, Thomas S. Journal of the American Chemical Society, 2005 , vol. 127, # 13 p. 4599 - 4608
  • Route3

    References

    • Liu, Yong-Mei; He, Lin; Wang, Miao-Miao; Cao, Yong; He, He-Yong; Fan, Kang-Nian ChemSusChem, 2012 , vol. 5, # 8 p. 1392 - 1396

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   43.09
  • LogP   0.7668
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   1

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