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CS-W001157 4
Total: USD 88.00

Methyl vanillate

  • CAS No. 3943-74-6

  • Cat. No. CS-D0814
  • Purity≥98%
  • MDL No.MFCD00008438

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

Methyl vanillate|CS-D0814

Structure of 3943-74-6

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General Information

  • CAS No. 3943-74-6
  • Cat. No. CS-D0814
  • Purity ≥98%
  • MDL No. MFCD00008438
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₀O₄
  • Molecular Weight None
  • Synonym(s) None
  • SMILES O=C(OC)C(C=C1)=CC(OC)=C1O

Description

Methyl vanillate is a volatile compound present in cloudberries (Rubus Chamaemorus.).Methyl vanillate was used to investigate the volatile compounds of heather honeys from Calluna vulgaris and Erica arborea.

Synthesis

  • Route1
    • null|null
      67-56-1
    • In-stock
      Vanillic acid|CS-0009728
      121-34-6
    • ~97%
    • In-stock
      Methyl vanillate|CS-D0814
      3943-74-6

    References

    • RESEARCH TRIANGLE INSTITUTE; CARROLL, Frank, I.; THOMAS, James, B.; NAVARRO, Hernan, A.; MASCARELLA, S., Wayne; RUNYON, Scott, P.; JIN, Chunyang; KORMOS, Chad, M. Patent: WO2013/86496 A2, 2013 ; Location in patent: Page/Page column 34 ;
  • Route2
    • null|null
      67-56-1
    • In-stock
      Lignin|CS-0093040
      9005-53-2
    • ~%
    • In-stock
      Methyl vanillate|CS-D0814
      3943-74-6
    • Vanillin, ≥97%|CS-1268660
      121-33-5

    References

    • ETH ZURICH Patent: US2010/121110 A1, 2010 ; Location in patent: Page/Page column 5-8 ;
  • Route3

    References

    • Chandrasekhar; Shyamsunder; Chandrashekar; Narsihmulu Synlett, 2004 , # 3 p. 522 - 524

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   55.76
  • LogP   1.1874
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   2

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