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CS-W001157 4
Total: USD 88.00

Methyl 4-(3-hydroxypropyl)benzoate

  • CAS No. 15403-22-2

  • Cat. No. CS-0563905
  • Molecule weight194.23
  • Purity≥98%
  • MDL No.MFCD16658291

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

Methyl 4-(3-hydroxypropyl)benzoate|CS-0563905

Structure of 15403-22-2

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General Information

  • CAS No. 15403-22-2
  • Cat. No. CS-0563905
  • Purity ≥98%
  • MDL No. MFCD16658291
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₄O₃
  • Molecular Weight 194.23
  • Synonym(s) None
  • SMILES O=C(C1=CC=C(CCCO)C=C1)OC

Synthesis

  • Route1

    References

    • Varney, Michael D.; Palmer, Cindy L.; Romines III, William H.; Boritzki, Theodore; Margosiak, Stephen A.; Almassy, Robert; Janson, Cheryl A.; Bartlett, Charlotte; Howland, Eleanor J.; Ferre, Rosanne Journal of Medicinal Chemistry, 1997 , vol. 40, # 16 p. 2502 - 2524
  • Route2
    • 4-(3-Hydroxypropyl)benzoic acid|CS-0566926
      58810-87-0
    • ~91%
    • Methyl 4-(3-hydroxypropyl)benzoate|CS-0563905
      15403-22-2

    References

    • Bayer Aktiengesellschaft Patent: US5041638 A1, 1991 ;
  • Route3

    References

    • Taylor, Edward C.; Gillespie, Paul; Patel, Mona Journal of Organic Chemistry, 1992 , vol. 57, # 11 p. 3218 - 3225

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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   46.53
  • LogP   1.3981
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   4

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