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CS-W001157 4
Total: USD 88.00

Ethyl 5-cyano-6-methyl-2-(trifluoromethyl)nicotinate

  • CAS No. 445-71-6

  • Cat. No. CS-0323135
  • Molecule weight258.20
  • Purity≥97%
  • MDL No.None

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

Ethyl 5-cyano-6-methyl-2-(trifluoromethyl)nicotinate|CS-0323135

Structure of 445-71-6

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General Information

  • CAS No. 445-71-6
  • Cat. No. CS-0323135
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₉F₃N₂O₂
  • Molecular Weight 258.20
  • Synonym(s) ethyl 5-cyano-6-methyl-2-(trifluoromethyl)pyridine-3-carboxylate
  • SMILES CCOC(=O)C1=C(C(F)(F)F)N=C(C)C(=C1)C#N

Synthesis

  • Route1

    References

    • Jones Journal of the American Chemical Society, 1952 , vol. 74, p. 1489

Safety Information

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GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301-H312+H332-H315-H319-H335
Precautionary Statements : P264-P270-P330-P405-P501

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Computational Chemistry Data

  • TPSA   62.98
  • LogP   2.4572
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   2

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