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CS-W001157 4
Total: USD 88.00

Isohomovanillic acid

  • CAS No. 1131-94-8

  • Cat. No. CS-W002110
  • Molecule weight182.18
  • Purity≥96%
  • MDL No.MFCD00016829

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

Isohomovanillic acid|CS-W002110

Structure of 1131-94-8

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General Information

  • CAS No. 1131-94-8
  • Cat. No. CS-W002110
  • Purity ≥96%
  • MDL No. MFCD00016829
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₀O₄
  • Molecular Weight 182.18
  • Synonym(s) 3-Hydroxy-4-methoxyphenylacetic acid; iso-HVA; Homoisovanillic acid
  • SMILES O=C(O)CC1=CC=C(OC)C(O)=C1

Synthesis

  • Route1

    References

    • Weller, Dwight D.; Stirchak, Eugene P.; Yokoyama, Ayumu Journal of Organic Chemistry, 1984 , vol. 49, # 11 p. 2061 - 2063
  • Route2
    • null|null
      81038-48-4
    • ~74%
    • In-stock
      Isohomovanillic acid|CS-W002110
      1131-94-8

    References

    • Szantay; Dornyei; Blasko; et al. Archiv der Pharmazie, 1981 , vol. 314, # 12 p. 983 - 991
  • Route3

    References

    • Bioorganic and Medicinal Chemistry, , vol. 21, # 4 p. 856 - 868

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-P302+P352

Quality Control

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Computational Chemistry Data

  • TPSA   66.76
  • LogP   1.0279
  • H_Acceptors   3
  • H_Donors   2
  • Rotatable_Bonds   3

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