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CS-W001157 4
Total: USD 88.00

4-Amino-3-chloro-5-nitrobenzotrifluoride

  • CAS No. 57729-79-0

  • Cat. No. CS-0204640
  • Purity≥98%
  • MDL No.MFCD00042153

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

4-Amino-3-chloro-5-nitrobenzotrifluoride|CS-0204640

Structure of 57729-79-0

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General Information

  • CAS No. 57729-79-0
  • Cat. No. CS-0204640
  • Purity ≥98%
  • MDL No. MFCD00042153
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₄ClF₃N₂O₂
  • Molecular Weight 240.57
  • Synonym(s) 2-Chloro-6-nitro-4-(trifluoromethyl)aniline
  • SMILES O=N(=O)C1=CC(=CC(Cl)=C1N)C(F)(F)F

Synthesis

  • Route1
    • 1-Chloro-2-fluoro-3-nitro-5-(trifluoromethyl)benzene|CS-0321552
      101646-02-0
    • ~93%
    • In-stock
      4-Amino-3-chloro-5-nitrobenzotrifluoride|CS-0204640
      57729-79-0

    References

    • Collins; McFarlane; Mackie; Smith Tetrahedron, 1992 , vol. 48, # 37 p. 7887 - 7898

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-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   69.16
  • LogP   2.8492
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   1

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