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CS-W001157 4
Total: USD 88.00

o-Toluic acid Tolvaptan Impurity

  • CAS No. 118-90-1

  • Cat. No. CS-0229343
  • Purity≥98%
  • MDL No.MFCD00002477

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

o-Toluic acid Tolvaptan  Impurity|CS-0229343

Structure of 118-90-1

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General Information

  • CAS No. 118-90-1
  • Cat. No. CS-0229343
  • Purity ≥98%
  • MDL No. MFCD00002477
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₈O₂
  • Molecular Weight 136.15
  • Synonym(s) None
  • SMILES O=C(O)C1=CC=CC=C1C

Synthesis

  • Route1

    References

    • Madler; Klucik; Soell; Brown; Liu; Berlin; Benbrook; Birckbichler; Nelson Organic Preparations and Procedures International, 1998 , vol. 30, # 2 p. 230 - 234
  • Route2
    • null|null
      124-38-9
    • 5,5-Dimethyl-2-(o-tolyl)-1,3,2-dioxaborinane|CS-0174860
      91994-11-5
    • ~74%
    • o-Toluic acid Tolvaptan  Impurity|CS-0229343
      118-90-1

    References

    • Ukai, Kazutoshi; Aoki, Masao; Takaya, Jun; Iwasawa, Nobuharu Journal of the American Chemical Society, 2006 , vol. 128, # 27 p. 8706 - 8707
  • Route3
    • null|null
      124-38-9
    • null|null
      95-46-5
    • ~56%
    • o-Toluic acid Tolvaptan  Impurity|CS-0229343
      118-90-1

    References

    • Correa, Arkaitz; Martin, Ruben Journal of the American Chemical Society, 2009 , vol. 131, # 44 p. 15974 - 15975

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   37.3
  • LogP   1.69322
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   1

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