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CS-W001157 4
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2-Amino-3-trifluoromethylbenzonitrile

  • CAS No. 58458-14-3

  • Cat. No. CS-0099431
  • Molecule weight186.13
  • Purity≥98%
  • MDL No.MFCD04972665

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

2-Amino-3-trifluoromethylbenzonitrile|CS-0099431

Structure of 58458-14-3

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General Information

  • CAS No. 58458-14-3
  • Cat. No. CS-0099431
  • Purity ≥98%
  • MDL No. MFCD04972665
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₅F₃N₂
  • Molecular Weight 186.13
  • Synonym(s) 2-Amino-3-(trifluoromethyl)benzonitrile
  • SMILES N#CC1=CC=CC(C(F)(F)F)=C1N

Synthesis

  • Route1
    • null|null
      74409-80-6
    • ~%
    • In-stock
      2-Amino-3-trifluoromethylbenzonitrile|CS-0099431
      58458-14-3

    References

    • Journal of the Chemical Society, Chemical Communications, , # 6 p. 374 - 375
  • Route2
    • null|null
      91534-21-3
    • ~%
    • In-stock
      2-Amino-3-trifluoromethylbenzonitrile|CS-0099431
      58458-14-3

    References

    • Journal of the Chemical Society, Chemical Communications, , # 6 p. 374 - 375
  • Route3
    • null|null
      91534-20-2
    • ~%
    • In-stock
      2-Amino-3-trifluoromethylbenzonitrile|CS-0099431
      58458-14-3

    References

    • Journal of the Chemical Society, Chemical Communications, , # 6 p. 374 - 375

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05,GHS06
Signal Word : Danger
UN#: 3439
Class : 6.1
Packing Group : Ⅰ
Hazard Statements : H227-H290-H314-H330
Precautionary Statements : P210-P234-P260-P264-P271-P280-P284-P301+P330+P331-P304+P340-P363-P370+P378-P390-P403-P405-P406-P501

Quality Control

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Computational Chemistry Data

  • TPSA   49.81
  • LogP   2.15928
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   0

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