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CS-W001157 4
Total: USD 88.00

2,3-Difluoro-5-nitrobenzonitrile

  • CAS No. 1247885-40-0

  • Cat. No. CS-0157905
  • Purity≥97%
  • MDL No.MFCD24038781

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

2,3-Difluoro-5-nitrobenzonitrile|CS-0157905

Structure of 1247885-40-0

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General Information

  • CAS No. 1247885-40-0
  • Cat. No. CS-0157905
  • Purity ≥97%
  • MDL No. MFCD24038781
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₂F₂N₂O₂
  • Molecular Weight 184.10
  • Synonym(s) Benzonitrile, 2,3-difluoro-5-nitro-
  • SMILES C1=C(C#N)C(=C(C=C1[N+](=O)[O-])F)F

Synthesis

  • Route1

    References

    • SEPRACOR INC.; BURDI, Douglas; SPEAR, Kerry, L.; HARDY, Larry, Wendell Patent: WO2010/114971 A1, 2010 ; Location in patent: Page/Page column 236-237 ;

Safety Information

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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   66.93
  • LogP   1.74468
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   1

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