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CS-W001157 4
Total: USD 88.00

3,3-Diphenylpropanoic acid

  • CAS No. 606-83-7

  • Cat. No. CS-W010427
  • Purity≥97%
  • MDL No.MFCD00002717

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

3,3-Diphenylpropanoic acid|CS-W010427

Structure of 606-83-7

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General Information

  • CAS No. 606-83-7
  • Cat. No. CS-W010427
  • Purity ≥97%
  • MDL No. MFCD00002717
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₅H₁₄O₂
  • Molecular Weight 226.28
  • Synonym(s) Benzhydrylacetic acid
  • SMILES O=C(O)CC(C1=CC=CC=C1)C2=CC=CC=C2

Description

3,3-Diphenylpropanoic acid features a sterically congested benzylic carbon flanked by two aryl rings, imparting high rigidity and enhanced metabolic stability. This structural motif enables direct incorporation into bioactive scaffolds where lipophilicity and conformational restraint are critical. The carboxylic acid functionality supports derivatization under standard coupling conditions.

Application

3,3-Diphenylpropanoic acid serves as a valuable building block in synthetic organic chemistry, enabling the construction of biaryl-containing scaffolds and functionalized heterocycles. Its benzylic carboxylic acid functionality facilitates direct derivatization via esterification, amide coupling, or decarboxylation protocols. The molecule exhibits good bench stability and is compatible with standard purification techniques, making it well-suited for iterative synthesis workflows in medicinal chemistry and materials science applications.

Synthesis

  • Route1
    • null|null
      4279-81-6
    • ~95%
    • In-stock
      3,3-Diphenylpropanoic acid|CS-W010427
      606-83-7

    References

    • Marchetti; Sechi; Botteghi; Paganelli Bollettino Chimico Farmaceutico, 1998 , vol. 137, # 3 p. 74 - 76
  • Route2
    • (S)-1,1-Diphenylpropan-2-ol|CS-0565921
      41997-47-1
    • ~%
    • In-stock
      3,3-Diphenylpropanoic acid|CS-W010427
      606-83-7

    References

    • US3953494 A1, ;
  • Route3
    • 1,1-Diphenylacetone|CS-0622558
      781-35-1
    • ~%
    • In-stock
      3,3-Diphenylpropanoic acid|CS-W010427
      606-83-7

    References

    • US3953494 A1, ;

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-P302+P352-P304+P340

Quality Control

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Computational Chemistry Data

  • TPSA   37.3
  • LogP   3.2932
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   4

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