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CS-W001157 4
Total: USD 88.00

2-Methyl-4-(2-methylbenzamido)benzoic acid

  • CAS No. 317374-08-6

  • Cat. No. CS-0152974
  • Molecule weight269.30
  • Purity≥97%
  • MDL No.MFCD16038736

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

2-Methyl-4-(2-methylbenzamido)benzoic acid|CS-0152974

Structure of 317374-08-6

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General Information

  • CAS No. 317374-08-6
  • Cat. No. CS-0152974
  • Purity ≥97%
  • MDL No. MFCD16038736
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₆H₁₅NO₃
  • Molecular Weight 269.30
  • Synonym(s) Tolvaptan side chain
  • SMILES CC1=CC=CC=C1C(=O)NC2=CC=C(C(=C2)C)C(=O)O

Synthesis

  • Route1
    • null|null
      928151-34-2
    • ~76%
    • In-stock
      2-Methyl-4-(2-methylbenzamido)benzoic acid|CS-0152974
      317374-08-6

    References

    • OTSUKA PHARMACEUTICAL CO., LTD. Patent: WO2007/26971 A2, 2007 ; Location in patent: Page/Page column 36-37 ;
  • Route2
    • null|null
      201230-82-2
    • null|null
      317374-07-5
    • ~81%
    • In-stock
      2-Methyl-4-(2-methylbenzamido)benzoic acid|CS-0152974
      317374-08-6

    References

    • Torisawa, Yasuhiro; Nishi, Takao; Minamikawa, Jun-ichi Bioorganic and Medicinal Chemistry Letters, 2000 , vol. 10, # 21 p. 2493 - 2495
  • Route3

    References

    • Torisawa, Yasuhiro; Furuta, Takuya; Nishi, Takao; Aki, Shinji; Minamikawa, Jun-ichi Bioorganic and Medicinal Chemistry Letters, 2007 , vol. 17, # 23 p. 6455 - 6458

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-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   66.4
  • LogP   3.25394
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   3

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