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2-(3-Ethoxyphenoxy)acetic acid

  • CAS No. 6459-12-7

  • Cat. No. CS-0466072
  • Molecule weight196.20
  • Purity≥98%
  • MDL No.MFCD06823834

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

2-(3-Ethoxyphenoxy)acetic acid|CS-0466072

Structure of 6459-12-7

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General Information

  • CAS No. 6459-12-7
  • Cat. No. CS-0466072
  • Purity ≥98%
  • MDL No. MFCD06823834
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₂O₄
  • Molecular Weight 196.20
  • Synonym(s) 3-Ethoxyphenoxyacetic acid
  • SMILES CCOC1=CC(=CC=C1)OCC(=O)O

Synthesis

  • Route1
    • null|null
      1163694-84-5
    • ~98%
    • 2-(3-Ethoxyphenoxy)acetic acid|CS-0466072
      6459-12-7

    References

    • ALLERGAN, INC.; EHRING, George, R.; CHAO, Ellen; NG, Herman; TON, Hau; LI, Jia Chian; ADORANTE, Joseph, S.; GARST, Michael, E.; RIND, Howard, B.; HANSEN, Mark, R.; AVEY, JR., Alfred, A.; DOLBY, Lloyd, J.; ESFANDIARI, Shervin; MACKENZIE, Vivian, R.; MARSDEN, Jeremiah, A.; MUCHMORE, David, C. Patent: WO2013/101911 A2, 2013 ; Location in patent: Page/Page column 29 ;
  • Route2

    References

    • Nametkin et al. Zhurnal Analiticheskoi Khimii, 1950 , vol. 5, p. 7,8 Chem.Abstr., 1950 , p. 4374 Full Text Show Details Nametkin et al. Doklady Akademii Nauk SSSR, 1949 , vol. 68, p. 77,79 Chem.Abstr., 1950 , p. 1936
  • Route3

    References

    • Merck u. Co., Inc. Patent: BE612755 , 1962 ; Chem.Abstr., 1963 , vol. 59, # 12712

Safety Information

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Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   55.76
  • LogP   1.5487
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   5

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