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5-(trifluoromethyl)benzo[d]isoxazol-3-amine

  • CAS No. 868271-14-1

  • Cat. No. CS-0456705
  • Purity≥98%
  • MDL No.MFCD11847114

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

5-(trifluoromethyl)benzo[d]isoxazol-3-amine|CS-0456705

Structure of 868271-14-1

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General Information

  • CAS No. 868271-14-1
  • Cat. No. CS-0456705
  • Purity ≥98%
  • MDL No. MFCD11847114
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₅F₃N₂O
  • Molecular Weight 202.13
  • Synonym(s) None
  • SMILES FC(F)(F)C=1C=CC=2ON=C(N)C2C1

Synthesis

  • Route1

    References

    • Zhang, Xuqing; Hufnagel, Heather; Hou, Cuifen; Opas, Evan; McKenney, Sandra; Crysler, Carl; O'Neill, John; Johnson, Dana; Sui, Zhihua Bioorganic and Medicinal Chemistry Letters, 2011 , vol. 21, # 20 p. 6042 - 6048

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 : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   52.05
  • LogP   2.4288
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   0

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