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CS-W001157 4
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METHYL 2,3,4-TRIFLUORO-5-NITROBENZOATE

  • CAS No. 918321-24-1

  • Cat. No. CS-0061819
  • Purity≥97%
  • MDL No.None

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

METHYL 2,3,4-TRIFLUORO-5-NITROBENZOATE|CS-0061819

Structure of 918321-24-1

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General Information

  • CAS No. 918321-24-1
  • Cat. No. CS-0061819
  • Purity ≥97%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₄F₃NO₄
  • Molecular Weight 235.12
  • Synonym(s) Benzoic acid,2,3,4-trifluoro-5-nitro-,methyl ester
  • SMILES COC(=O)C1=CC(=C(C(=C1F)F)F)[N+](=O)[O-]

Synthesis

  • Route1

    References

    • ARRAY BIOPHARMA INC.; ASTRAZENECA AB Patent: WO2007/2157 A2, 2007 ; Location in patent: Page/Page column 69 ; WO 2007/002157 A2

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-H320-H335
Precautionary Statements : P264-P270-P330

Quality Control

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Computational Chemistry Data

  • TPSA   69.44
  • LogP   1.7987
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   2

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