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CS-W001157 4
Total: USD 88.00

1-(4-((Trifluoromethyl)thio)phenyl)ethan-1-one

  • CAS No. 713-67-7

  • Cat. No. CS-0272086
  • Molecule weight220.21
  • Purity≥98%
  • MDL No.None

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

1-(4-((Trifluoromethyl)thio)phenyl)ethan-1-one|CS-0272086

Structure of 713-67-7

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General Information

  • CAS No. 713-67-7
  • Cat. No. CS-0272086
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₇F₃OS
  • Molecular Weight 220.21
  • Synonym(s) 4'-(Trifluoromethylthio)acetophenone
  • SMILES CC(=O)C1=CC=C(C=C1)SC(F)(F)F

Synthesis

  • Route1

    References

    • Tetrahedron, , vol. 69, # 48 p. 10262 - 10266
  • Route2

    References

    • Danoun, Gregory; Bayarmagnai, Bilguun; Gruenberg, Matthias F.; Goossen, Lukas J. Chemical Science, 2014 , vol. 5, # 4 p. 1312 - 1316
  • Route3

    References

    • Weng, Zhiqiang; He, Weiming; Chen, Chaohuang; Lee, Richmond; Tan, Davin; Lai, Zhiping; Kong, Dedao; Yuan, Yaofeng; Huang, Kuo-Wei Angewandte Chemie - International Edition, 2013 , vol. 52, # 5 p. 1548 - 1552 Angew. Chem., 2013 , vol. 125, # 5 p. 1588 - 1592

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
Precautionary Statements : P264-P270-P330-P501

Quality Control

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Computational Chemistry Data

  • TPSA   17.07
  • LogP   3.5011
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   2

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