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CS-W001157 4
Total: USD 88.00

2,2,2-Trifluoro-1-(4-nitrophenyl)ethanol

  • CAS No. 241127-76-4

  • Cat. No. CS-0380505
  • Molecule weight221.13
  • Purity≥98%
  • MDL No.None

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

2,2,2-Trifluoro-1-(4-nitrophenyl)ethanol|CS-0380505

Structure of 241127-76-4

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General Information

  • CAS No. 241127-76-4
  • Cat. No. CS-0380505
  • Purity ≥98%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₆F₃NO₃
  • Molecular Weight 221.13
  • Synonym(s) Benzenemethanol, 4-nitro-alpha-(trifluoromethyl)- (9CI)
  • SMILES OC(C(F)(F)F)C1=CC=C([N+]([O-])=O)C=C1

Synthesis

  • Route1

    References

    • THE UNITED STATES GOVERNMENT as represented by THE DEPARTMENT OF HEALTH AND HUMAN SERVICES Patent: EP1367046 A1, 2003 ; Location in patent: Page 27 ; EP 1367046 A1
  • Route2
    • null|null
      75-46-7
    • In-stock
      4-Nitrobenzaldehyde|CS-W007577
      555-16-8
    • ~51%
    • In-stock
      2,2,2-Trifluoro-1-(4-nitrophenyl)ethanol|CS-0380505
      241127-76-4

    References

    • Kawai, Hiroyuki; Yuan, Zhe; Tokunaga, Etsuko; Shibata, Norio Organic and Biomolecular Chemistry, 2013 , vol. 11, # 9 p. 1446 - 1450
  • Route3

    References

    • Zhao, Yanchuan; Zhu, Jieming; Ni, Chuanfa; Hu, Jinbo Synthesis, 2010 , # 11 art. no. C00810SS, p. 1899 - 1904

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   63.37
  • LogP   2.1905
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   2

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