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CS-W001157 4
Total: USD 88.00

2-(2-Methylbenzoyl)benzoic acid

  • CAS No. 5469-51-2

  • Cat. No. CS-0580730
  • Purity≥98%
  • MDL No.None

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

2-(2-Methylbenzoyl)benzoic acid|CS-0580730

Structure of 5469-51-2

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General Information

  • CAS No. 5469-51-2
  • Cat. No. CS-0580730
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₅H₁₂O₃
  • Molecular Weight 240.25
  • Synonym(s) 2-(2-methylphenyl)carbonylbenzoic acid
  • SMILES CC1=CC=CC=C1C(=O)C2=CC=CC=C2C(=O)O

Synthesis

  • Route1
    • null|null
      85-44-9
    • null|null
      7664-93-9
    • null|null
      95-50-1
    • ~%
    • 2-(2-Methylbenzoyl)benzoic acid|CS-0580730
      5469-51-2

    References

    • FMC Corporation Patent: US4766240 A1, 1988 ;
  • Route2
    • null|null
      932-31-0
    • null|null
      85-44-9
    • ~81%
    • 2-(2-Methylbenzoyl)benzoic acid|CS-0580730
      5469-51-2

    References

    • Konosonoks, Armands; Wright, P. John; Tsao, Meng-Lin; Pika, Jana; Novak, Kevin; Mandel, Sarah M.; Krause Bauer, Jeanette A.; Bohne, Cornelia; Gudmundsdottir, Anna D. Journal of Organic Chemistry, 2005 , vol. 70, # 7 p. 2763 - 2770
  • Route3
    • null|null
      862204-34-0
    • null|null
      64-19-7
    • ~%
    • 2-(2-Methylbenzoyl)benzoic acid|CS-0580730
      5469-51-2

    References

    • Brand; Ludwig; Berlin Journal fuer Praktische Chemie (Leipzig), 1925 , vol. <2> 110, p. 32

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   54.37
  • LogP   2.92422
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   3

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