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CS-W001157 4
Total: USD 88.00

4-Benzylbenzoic acid

  • CAS No. 620-86-0

  • Cat. No. CS-0257498
  • Purity≥98%
  • MDL No.None

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

4-Benzylbenzoic acid|CS-0257498

Structure of 620-86-0

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General Information

  • CAS No. 620-86-0
  • Cat. No. CS-0257498
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₁₂O₂
  • Molecular Weight 212.24
  • Synonym(s) DIPHENYLMETHANE-4-CARBOXYLIC ACID
  • SMILES C1=CC=C(C=C1)CC2=CC=C(C=C2)C(=O)O

Synthesis

  • Route1

    References

    • Syntex USA (LLC) Patent: US6184242 B2, 2001 ;
  • Route2
    • 4-Benzylbenzonitrile|CS-0766851
      23450-31-9
    • ~83%
    • 4-Benzylbenzoic acid|CS-0257498
      620-86-0

    References

    • Barchiesi, Emma; Bradamante, Silvia; Pagani, Giorgio A. Journal of the Chemical Society, Perkin Transactions 2: Physical Organic Chemistry (1972-1999), 1987 , p. 1091 - 1096
  • Route3

    References

    • US5202356 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 : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   37.3
  • LogP   2.9756
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   3

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