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CS-W001157 4
Total: USD 88.00

Ethyl Vanillate

  • CAS No. 617-05-0

  • Cat. No. CS-0013594
  • Molecule weight196.20
  • Purity≥97%
  • MDL No.MFCD00017269

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

Ethyl Vanillate|CS-0013594

Structure of 617-05-0

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General Information

  • CAS No. 617-05-0
  • Cat. No. CS-0013594
  • Purity ≥97%
  • MDL No. MFCD00017269
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₂O₄
  • Molecular Weight 196.20
  • Synonym(s) 4-Hydroxy-3-methoxybenzoic Acid Ethyl Ester;Ethyl 4-hydroxy-3-methoxybenzoate
  • SMILES O=C(OCC)C1=CC=C(O)C(OC)=C1

Synthesis

  • Route1

    References

    • US6638928 B1, ;
  • Route2
    • null|null
      64-17-5
    • In-stock
      Lignin|CS-0093040
      9005-53-2
    • ~%
    • In-stock
      Ethyl Vanillate|CS-0013594
      617-05-0
    • null|null
      18256-48-9
    • Vanillin, ≥97%|CS-1268660
      121-33-5

    References

    • US2010/121110 A1, ; Page/Page column 5-8 ;
  • Route3
    • null|null
      64-17-5
    • In-stock
      Vanillic acid|CS-0009728
      121-34-6
    • ~81%
    • In-stock
      Ethyl Vanillate|CS-0013594
      617-05-0

    References

    • Kumar, Rakesh; Ramachandran, Uma; Srinivasan, Krishnamoorthy; Ramarao, Poduri; Raichur, Suryaprakash; Chakrabarti, Ranjan Bioorganic and Medicinal Chemistry, 2005 , vol. 13, # 13 p. 4279 - 4290

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   55.76
  • LogP   1.5775
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   3

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