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CS-W001157 4
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5'-Chloro-2'-hydroxy-3'-nitro-[1,1'-biphenyl]-3-carboxylic acid

  • CAS No. 376592-58-4

  • Cat. No. CS-B0771
  • Molecule weight293.66
  • Purity≥95%
  • MDL No.MFCD13184302

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

5'-Chloro-2'-hydroxy-3'-nitro-[1,1'-biphenyl]-3-carboxylic acid|CS-B0771

Structure of 376592-58-4

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General Information

  • CAS No. 376592-58-4
  • Cat. No. CS-B0771
  • Purity ≥95%
  • MDL No. MFCD13184302
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₈ClNO₅
  • Molecular Weight 293.66
  • Synonym(s) [1,1'-Biphenyl]-3-carboxylic acid, 5'-chloro-2'-hydroxy-3'-nitro
  • SMILES O=C(C1=CC(C2=CC(Cl)=CC([N+]([O-])=O)=C2O)=CC=C1)O

Synthesis

  • Route1
    • 5'-Chloro-2'-hydroxy-[1,1'-biphenyl]-3-carboxylic acid|CS-B0770
      376592-57-3
    • ~90%
    • 5'-Chloro-2'-hydroxy-3'-nitro-[1,1'-biphenyl]-3-carboxylic acid|CS-B0771
      376592-58-4

    References

    • ASSIA CHEMICAL INDUSTRIES LTD.; TEVA PHARMACEUTICAL USA, INC.; AVDAGIC, Amir; BARAN, Phil, S. Patent: WO2013/49605 A1, 2013 ; Location in patent: Paragraph 0052 ;
  • Route2

    References

    • WO2013/49605 A1, ; Paragraph 0055 ;
  • Route3

    References

    • WO2013/49605 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

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Computational Chemistry Data

  • TPSA   100.67
  • LogP   3.319
  • H_Acceptors   4
  • H_Donors   2
  • Rotatable_Bonds   3

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