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CS-W001157 4
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2,5-Dimethyl-1-[4-(trifluoromethyl)phenyl]-1H-pyrrole

  • CAS No. 570-05-8

  • Cat. No. CS-0206573
  • Molecule weight239.24
  • Purity≥98%
  • MDL No.MFCD00085042

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

2,5-Dimethyl-1-[4-(trifluoromethyl)phenyl]-1H-pyrrole|CS-0206573

Structure of 570-05-8

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General Information

  • CAS No. 570-05-8
  • Cat. No. CS-0206573
  • Purity ≥98%
  • MDL No. MFCD00085042
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₂F₃N
  • Molecular Weight 239.24
  • Synonym(s) 2,5-Dimethyl-1-[4-(trifluoromethyl)phenyl]pyrrole
  • SMILES CC1=CC=C(C)N1C2=CC=C(C=C2)C(F)(F)F

Synthesis

  • Route1

    References

    • Murugesan, Dinakaran; Mital, Alka; Kaiser, Marcel; Shackleford, David M.; Morizzi, Julia; Katneni, Kasiram; Campbell, Michael; Hudson, Alan; Charman, Susan A.; Yeates, Clive; Gilbert, Ian H. Journal of Medicinal Chemistry, 2013 , vol. 56, # 7 p. 2975 - 2990

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   4.93
  • LogP   4.11294
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   1

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