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(E)-3-(Dimethylamino)-1-(4-fluorophenyl)prop-2-en-1-one

  • CAS No. 138716-20-8

  • Cat. No. CS-0166884
  • Molecule weight193.22
  • Purity≥98%
  • MDL No.MFCD00111509

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

(E)-3-(Dimethylamino)-1-(4-fluorophenyl)prop-2-en-1-one|CS-0166884

Structure of 138716-20-8

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General Information

  • CAS No. 138716-20-8
  • Cat. No. CS-0166884
  • Purity ≥98%
  • MDL No. MFCD00111509
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₂FNO
  • Molecular Weight 193.22
  • Synonym(s) (2E)-3-(DiMethylaMino)-1-(4-fluorophenyl)prop-2-en-1-one
  • SMILES O=C(C1=CC=C(F)C=C1)/C=C/N(C)C

Synthesis

  • Route1

    References

    • Kumar, Dinesh; Kommi, Damodara N.; Chopra, Pradeep; Ansari, Md Imam; Chakraborti, Asit K. European Journal of Organic Chemistry, 2012 , # 32 p. 6407 - 6413,7
  • Route2

    References

    • Tang, Qidong; Zhao, Yanfang; Du, Xinming; Chong, Lian'E; Gong, Ping; Guo, Chun European Journal of Medicinal Chemistry, 2013 , vol. 69, p. 77 - 89
  • Route3

    References

    • American Cyanamid Company Patent: US4209621 A1, 1980 ;

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   20.31
  • LogP   2.7198
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   3

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