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(S)-3-(4-(Benzyloxy)phenyl)-2-hydroxypropanoicacid

  • CAS No. 162919-37-1

  • Cat. No. CS-0171393
  • Molecule weight272.30
  • Purity≥97%
  • MDL No.MFCD07369853

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

(S)-3-(4-(Benzyloxy)phenyl)-2-hydroxypropanoicacid|CS-0171393

Structure of 162919-37-1

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General Information

  • CAS No. 162919-37-1
  • Cat. No. CS-0171393
  • Purity ≥97%
  • MDL No. MFCD07369853
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₆H₁₆O₄
  • Molecular Weight 272.30
  • Synonym(s) Benzenepropanoic acid, α-hydroxy-4-(phenylmethoxy)-, (alphaS)-
  • SMILES C1=CC=C(C=C1)COC2=CC=C(C=C2)C[C@@H](C(=O)O)O

Synthesis

  • Route1

    References

    • CADILA HEALTHCARE LIMITED Patent: WO2005/19152 A2, 2005 ; Location in patent: Page/Page column 12; 13 ;
  • Route2
    • null|null
      267228-34-2
    • ~10%
    • (S)-3-(4-(Benzyloxy)phenyl)-2-hydroxypropanoicacid|CS-0171393
      162919-37-1

    References

    • Valls, Nativitat; Vallribera, Merce; Lopez-Canet, Meritxell; Bonjoch, Josep Journal of Organic Chemistry, 2002 , vol. 67, # 14 p. 4945 - 4950
  • Route3

    References

    • Aikins, James A.; Haurez, Michael; Rizzo, John R.; Van Hoeck, Jean-Pierre; Brione, Willy; Kestemont, Jean-Paul; Stevens, Christophe; Lemair, Xavier; Stephenson, Gregory A.; Marlot, Eric; Forst, Mindy; Houpis, Ioannis N. Journal of Organic Chemistry, 2005 , vol. 70, # 12 p. 4695 - 4705

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-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   66.76
  • LogP   2.2536
  • H_Acceptors   3
  • H_Donors   2
  • Rotatable_Bonds   6

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