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CS-W001157 4
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Methyl 2-propoxybenzoate

  • CAS No. 18167-33-4

  • Cat. No. CS-0522072
  • Molecule weight194.23
  • Purity≥98%
  • MDL No.MFCD07780728

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

Methyl 2-propoxybenzoate|CS-0522072

Structure of 18167-33-4

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General Information

  • CAS No. 18167-33-4
  • Cat. No. CS-0522072
  • Purity ≥98%
  • MDL No. MFCD07780728
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₄O₃
  • Molecular Weight 194.23
  • Synonym(s) METHYL 2-N-PROPYLOXYBENZOATE
  • SMILES O=C(OC)C1=CC=CC=C1OCCC

Synthesis

  • Route1
    • null|null
      107-08-4
    • Methyl salicylate, food grade|CS-0890223
      119-36-8
    • ~%
    • Methyl 2-propoxybenzoate|CS-0522072
      18167-33-4

    References

    • Rotella; Sun; Zhu; Krupinski; Pongrac; Seliger; Normandin; Macor Journal of Medicinal Chemistry, 2000 , vol. 43, # 26 p. 5037 - 5043
  • Route2
    • null|null
      106-94-5
    • ~%
    • Methyl 2-propoxybenzoate|CS-0522072
      18167-33-4

    References

    • Pierce; Salsbury; Fredericksen Journal of the American Chemical Society, 1942 , vol. 64, p. 1691,1692
  • Route3
    • null|null
      106-94-5
    • Methyl salicylate, food grade|CS-0890223
      119-36-8
    • ~%
    • Methyl 2-propoxybenzoate|CS-0522072
      18167-33-4

    References

    • Coates, William J.; Connolly, Brendan; Dhanak, Dashyant; Flynn, Sean T.; Worby, Angela Journal of Medicinal Chemistry, 1993 , vol. 36, # 10 p. 1387 - 1392

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

Quality Control

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Computational Chemistry Data

  • TPSA   35.53
  • LogP   2.262
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   4

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