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CS-W001157 4
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1-Benzyl-3-(trifluoromethyl)pyrrolidine-3-carboxylic acid

  • CAS No. 186203-08-7

  • Cat. No. CS-0216759
  • Purity≥97%
  • MDL No.None

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

1-Benzyl-3-(trifluoromethyl)pyrrolidine-3-carboxylic acid|CS-0216759

Structure of 186203-08-7

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General Information

  • CAS No. 186203-08-7
  • Cat. No. CS-0216759
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₄F₃NO₂
  • Molecular Weight 273.25
  • Synonym(s) 1-Benzyl-3-trifluoromethyl-pyrrolidine-3-carboxylic acid
  • SMILES C1=CC=C(C=C1)CN2CCC(C2)(C(=O)O)C(F)(F)F

Synthesis

  • Route1

    References

    • Fukui, Hideto; Shibata, Tetsuo; Naito, Takanobu; Nakano, Jun; Maejima, Tetsuro; Senda, Hisato; Iwatani, Wakao; Tatsumi, Yoshiyuki; Suda, Masahiro; Arika, Tadashi Bioorganic and Medicinal Chemistry Letters, 1998 , vol. 8, # 20 p. 2833 - 2838

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 : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   40.54
  • LogP   2.5256
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   3

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