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CS-W001157 4
Total: USD 88.00

4-(3-Methoxycarbonylphenyl)benzoic acid

  • CAS No. 281232-91-5

  • Cat. No. CS-0209496
  • Purity≥98%
  • MDL No.MFCD06802565

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

4-(3-Methoxycarbonylphenyl)benzoic acid|CS-0209496

Structure of 281232-91-5

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General Information

  • CAS No. 281232-91-5
  • Cat. No. CS-0209496
  • Purity ≥98%
  • MDL No. MFCD06802565
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₅H₁₂O₄
  • Molecular Weight 256.25
  • Synonym(s) 3'-(Methoxycarbonyl)[1,1'-biphenyl]-4-carboxylic acid
  • SMILES O=C(O)C1=CC=C(C2=CC=CC(C(OC)=O)=C2)C=C1

Synthesis

  • Route1

    References

    • Abdu-Allah, Hajjaj H. M.; Tamanaka, Taichi; Yu, Jie; Zhuoyuan, Lu; Sadagopan, Magesh; Adachi, Takahiro; Tsubata, Takeshi; Kelm, Soerge; Ishida, Hideharu; Kiso, Makoto Journal of Medicinal Chemistry, 2008 , vol. 51, # 21 p. 6665 - 6681

Safety Information

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Computational Chemistry Data

  • TPSA   63.6
  • LogP   2.8384
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   3

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