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    Technical details about 2,3,4-Trimethoxybenzoic Acid, learn more about the structure, uses, toxicity, action, side effects and more

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    2,3,4-Trimethoxybenzoic Acid

    PharmaCompass

    Farmhispania Group, a leading European CDMO in HPAPI Technologies & High Potency Fermentation.

    One Pharma aims to be one of the leading generic companies in Europe.

    2D Structure
    1. Also known as: 573-11-5, 2,3,4-trimethoxy-benzoic acid, Benzoic acid, 2,3,4-trimethoxy-, Mfcd00002433, Benzoic acid, trimethoxy-, Einecs 209-350-0
    Molecular Formula
    C10H12O5
    Molecular Weight
    212.20  g/mol
    InChI Key
    HZNQSWJZTWOTKM-UHFFFAOYSA-N
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    2,3,4-trimethoxybenzoic acid
    2.1.2 InChI
    InChI=1S/C10H12O5/c1-13-7-5-4-6(10(11)12)8(14-2)9(7)15-3/h4-5H,1-3H3,(H,11,12)
    2.1.3 InChI Key
    HZNQSWJZTWOTKM-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    COC1=C(C(=C(C=C1)C(=O)O)OC)OC
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 573-11-5

    2. 2,3,4-trimethoxy-benzoic Acid

    3. Benzoic Acid, 2,3,4-trimethoxy-

    4. Mfcd00002433

    5. Benzoic Acid, Trimethoxy-

    6. Einecs 209-350-0

    7. Trimethoxybenzoic Acid

    8. 50855-25-9

    9. Ap-065/41884107

    10. Schembl102827

    11. Dtxsid00205912

    12. Zinc156455

    13. Act00249

    14. Bcp34374

    15. Bbl027380

    16. Ck2163

    17. Stl257458

    18. Akos000119569

    19. Cs-w014274

    20. Gs-3092

    21. 2,3,4-trimethoxybenzoic Acid, >=98%

    22. Ac-11256

    23. Sy020854

    24. Db-005822

    25. Ds-007130

    26. Am20060674

    27. Ft-0601238

    28. T1116

    29. 573t115

    30. Benzoic Acid, Trimethoxy-;trimetazidine Impurity 4

    31. W-105474

    32. Q63408785

    33. F2191-0077

    34. Z219997442

    2.3 Create Date
    2005-03-26
    3 Chemical and Physical Properties
    Molecular Weight 212.20 g/mol
    Molecular Formula C10H12O5
    XLogP31.7
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count5
    Rotatable Bond Count4
    Exact Mass212.06847348 g/mol
    Monoisotopic Mass212.06847348 g/mol
    Topological Polar Surface Area65 Ų
    Heavy Atom Count15
    Formal Charge0
    Complexity218
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
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