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CS-W001157 4
Total: USD 88.00

Vanillyl alcohol

  • CAS No. 498-00-0

  • Cat. No. CS-0018572
  • Molecule weight154.16
  • Purity≥97%
  • MDL No.MFCD00004659

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

Vanillyl alcohol|CS-0018572

Structure of 498-00-0

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General Information

  • CAS No. 498-00-0
  • Cat. No. CS-0018572
  • Purity ≥97%
  • MDL No. MFCD00004659
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₁₀O₃
  • Molecular Weight 154.16
  • Synonym(s) p-(Hydroxymethyl)guaiacol
  • SMILES OCC1=CC=C(O)C(OC)=C1

Application

Vanillyl alcohol serves as a versatile building block in synthetic organic chemistry, enabling access to bioactive phenolic compounds and lignin-derived scaffolds. Its phenolic hydroxyl and primary alcohol functionalities offer orthogonal reactivity for selective derivatization, while the methoxy group enhances metabolic stability. The compound exhibits excellent bench stability and facilitates efficient purification, making it well-suited for medicinal chemistry campaigns and natural product synthesis.

Synthesis

  • Route1

    References

    • Lv, Zhongfei; Sun, Qi; Meng, Xiangju; Xiao, Feng-Shou Journal of Materials Chemistry A, 2013 , vol. 1, # 30 p. 8630 - 8635
  • Route2

    References

    • Zhou, Yuhan; Gao, Guchao; Li, Hui; Qu, Jingping Tetrahedron Letters, 2008 , vol. 49, # 20 p. 3260 - 3263
  • Route3
    • null|null
      1058649-10-7
    • ~92%
    • In-stock
      Vanillyl alcohol|CS-0018572
      498-00-0

    References

    • Mohammadpoor-Baltork, Iraj; Moghadam, Majid; Tangestaninejad, Shahram; Mirkhani, Valiollah; Khosropour, Ahmad Reza; Mirjafari, Arsalan Monatshefte fur Chemie, 2010 , vol. 141, # 10 p. 1083 - 1088

Safety Information

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GHS Pictogram : N/A
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Hazard Statements : N/A
Precautionary Statements : N/A

Quality Control

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Computational Chemistry Data

  • TPSA   49.69
  • LogP   0.8931
  • H_Acceptors   3
  • H_Donors   2
  • Rotatable_Bonds   2

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