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CS-W001157 4
Total: USD 88.00

4-(3-Methoxybenzoyl)benzoic acid

  • CAS No. 156727-76-3

  • Cat. No. CS-0235415
  • Purity≥95%
  • MDL No.None

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

4-(3-Methoxybenzoyl)benzoic acid|CS-0235415

Structure of 156727-76-3

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General Information

  • CAS No. 156727-76-3
  • Cat. No. CS-0235415
  • Purity ≥95%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₅H₁₂O₄
  • Molecular Weight 256.25
  • Synonym(s) 4-(3’-Methoxybenzoyl)benzoic Acid
  • SMILES COC1=CC=CC(=C1)C(=O)C2=CC=C(C=C2)C(=O)O

Synthesis

  • Route1
    • (3-Methoxyphenyl)(4-methylphenyl)methanone|CS-0235344
      82520-37-4
    • ~77%
    • 4-(3-Methoxybenzoyl)benzoic acid|CS-0235415
      156727-76-3

    References

    • Neuroscienze Pharmaness S.C. A R.L. Patent: EP2338889 A1, 2011 ; Location in patent: Page/Page column 69 ; EP 2338889 A1
  • Route2
    • null|null
      1711-05-3
    • ~%
    • 4-(3-Methoxybenzoyl)benzoic acid|CS-0235415
      156727-76-3

    References

    • Journal of Medicinal Chemistry, , vol. 40, # 5 p. 695 - 704
  • Route3
    • null|null
      108-88-3
    • ~%
    • 4-(3-Methoxybenzoyl)benzoic acid|CS-0235415
      156727-76-3

    References

    • Journal of Medicinal Chemistry, , vol. 40, # 5 p. 695 - 704

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-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   63.6
  • LogP   2.6244
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   4

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