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CS-W001157 4
Total: USD 88.00

Ethyl 4-(3-hydroxypropyl)benzoate

  • CAS No. 98092-75-2

  • Cat. No. CS-0312300
  • Molecule weight208.25
  • Purity≥95%
  • MDL No.None

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

Ethyl 4-(3-hydroxypropyl)benzoate|CS-0312300

Structure of 98092-75-2

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General Information

  • CAS No. 98092-75-2
  • Cat. No. CS-0312300
  • Purity ≥95%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₆O₃
  • Molecular Weight 208.25
  • Synonym(s) Benzoic acid,4-(3-hydroxypropyl)-,ethyl ester
  • SMILES O=C(OCC)C1=CC=C(CCCO)C=C1

Synthesis

  • Route1
    • null|null
      151864-81-2
    • ~95%
    • Ethyl 4-(3-hydroxypropyl)benzoate|CS-0312300
      98092-75-2

    References

    • GALDERMA RESEARCH and DEVELOPMENT,S.N.C. Patent: WO2006/63863 A1, 2006 ; Location in patent: Page/Page column 44; 1/2 ; WO 2006/063863 A1
  • Route2

    References

    • Baraldi; Cacciari; Romagnoli; Spalluto; Monopoli; Ongini; Varani; Borea Journal of Medicinal Chemistry, 2002 , vol. 45, # 1 p. 115 - 126
  • Route3
    • Ethyl 3-(4-cyanophenyl)prop-2-enoate|CS-0061538
      20655-58-7
    • ~%
    • Ethyl 4-(3-hydroxypropyl)benzoate|CS-0312300
      98092-75-2

    References

    • Baraldi; Cacciari; Romagnoli; Spalluto; Monopoli; Ongini; Varani; Borea Journal of Medicinal Chemistry, 2002 , vol. 45, # 1 p. 115 - 126

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   1.7882
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   5

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