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CS-W001157 4
Total: USD 88.00

N,N-Dimethyl-2-nitro-4-(trifluoromethyl)aniline

  • CAS No. 40700-38-7

  • Cat. No. CS-0210750
  • Purity≥98%
  • MDL No.MFCD00236670

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

N,N-Dimethyl-2-nitro-4-(trifluoromethyl)aniline|CS-0210750

Structure of 40700-38-7

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General Information

  • CAS No. 40700-38-7
  • Cat. No. CS-0210750
  • Purity ≥98%
  • MDL No. MFCD00236670
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₉F₃N₂O₂
  • Molecular Weight 234.18
  • Synonym(s) 4-DIMETHYLAMINO-3-NITROBENZOTRIFLUORIDE
  • SMILES CN(C)C1=C(C=C(C=C1)C(F)(F)F)[N+](=O)[O-]

Synthesis

  • Route1

    References

    • MERCK PATENT GMBH Patent: WO2004/37789 A2, 2004 ; Location in patent: Page 311 ; WO 2004/037789 A2
  • Route2

    References

    • Petersen, Trine P.; Larsen, Anders Foller; Ritzen, Andreas; Ulven, Trond Journal of Organic Chemistry, 2013 , vol. 78, # 8 p. 4190 - 4195

Safety Information

Download SDS
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

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Computational Chemistry Data

  • TPSA   46.38
  • LogP   2.6796
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   2

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