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3-Oxo-3-(3-((trifluoromethyl)thio)phenyl)propanenitrile

  • CAS No. 677713-04-1

  • Cat. No. CS-0499696
  • Purity≥98%
  • MDL No.None

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

3-Oxo-3-(3-((trifluoromethyl)thio)phenyl)propanenitrile|CS-0499696

Structure of 677713-04-1

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General Information

  • CAS No. 677713-04-1
  • Cat. No. CS-0499696
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₆F₃NOS
  • Molecular Weight 245.22
  • Synonym(s) None
  • SMILES FC(F)(F)SC1=CC=CC(=C1)C(=O)CC#N

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   40.86
  • LogP   3.39488
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   3

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