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CS-W001157 4
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2-(Benzyloxy)-5-methylbenzoic acid

  • CAS No. 67127-92-8

  • Cat. No. CS-0195855
  • Molecule weight242.27
  • Purity≥98%
  • MDL No.None

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

2-(Benzyloxy)-5-methylbenzoic acid|CS-0195855

Structure of 67127-92-8

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General Information

  • CAS No. 67127-92-8
  • Cat. No. CS-0195855
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₅H₁₄O₃
  • Molecular Weight 242.27
  • Synonym(s) 5-methyl-2-phenylmethoxybenzoic acid
  • SMILES O=C(O)C1=CC(C)=CC=C1OCC2=CC=CC=C2

Synthesis

  • Route1
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      1100844-42-5
    • ~%
    • 2-(Benzyloxy)-5-methylbenzoic acid|CS-0195855
      67127-92-8

    References

    • GLAXO GROUP LIMITED; GLAXOSMITHKLINE (CHINA) RandD COMPANY LIMITED; NICHOLS, Paula Louise; EATHERTON, Andrew John; BAMBOROUGH, Paul; JANDU, Karamjit Singh; PHILPS, Oliver James; ANDREOTTI, Daniele Patent: WO2011/38572 A1, 2011 ; Location in patent: Page/Page column 51 ; WO 2011/038572 A1
  • Route2

    References

    • Laursen, Jane B.; De Visser, Peter C.; Nielsen, Henrik K.; Jensen, Knud J.; Nielsen, John Bioorganic and Medicinal Chemistry Letters, 2002 , vol. 12, # 2 p. 171 - 175
  • Route3
    • null|null
      100-44-7
    • ~%
    • 2-(Benzyloxy)-5-methylbenzoic acid|CS-0195855
      67127-92-8

    References

    • Ford; Knowles; Lunt; et al. Journal of Medicinal Chemistry, 1986 , vol. 29, # 4 p. 538 - 549

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

Quality Control

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Computational Chemistry Data

  • TPSA   46.53
  • LogP   3.27222
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   4

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