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CS-W001157 4
Total: USD 88.00

2-Nitro-4-(trifluoromethyl)phenylacetic acid

  • CAS No. 1735-91-7

  • Cat. No. CS-0030406
  • Purity≥98%
  • MDL No.MFCD00091534

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

2-Nitro-4-(trifluoromethyl)phenylacetic acid|CS-0030406

Structure of 1735-91-7

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General Information

  • CAS No. 1735-91-7
  • Cat. No. CS-0030406
  • Purity ≥98%
  • MDL No. MFCD00091534
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₆F₃NO₄
  • Molecular Weight 249.14
  • Synonym(s) 2-Nitro-4-(trifluoromethyl)phenylaceticacid
  • SMILES O=C(O)CC1=CC=C(C(F)(F)F)C=C1[N+]([O-])=O

Synthesis

  • Route1
    • null|null
      120542-04-3
    • ~96%
    • In-stock
      2-Nitro-4-(trifluoromethyl)phenylacetic acid|CS-0030406
      1735-91-7

    References

    • Boehringer Ingelheim Pharma GmbH and Co. KG Patent: US6794395 B1, 2004 ; Location in patent: Page/Page column 18 ;
  • Route2
    • null|null
      7664-93-9
    • In-stock
      4-(Trifluoromethyl)phenylacetic acid|CS-W015432
      32857-62-8
    • ~%
    • In-stock
      2-Nitro-4-(trifluoromethyl)phenylacetic acid|CS-0030406
      1735-91-7

    References

    • US6057323 A1, ; US 6057323 A
  • Route3

    References

    • US2003/144272 A1, ;

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   80.44
  • LogP   2.2407
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   3

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