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    CAS 14192-26-8

    BUILDING BLOCK

    PharmaCompass
    Xls

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    2D Structure
    Also known as: 14192-26-8, Methyl oxindole-6-carboxylate, Methyl 2-oxindole-6-carboxylate, Methyl 2-oxoindole-6-carboxylate, 1h-indole-6-carboxylic acid, 2,3-dihydro-2-oxo-, methyl ester, Methyl 2-oxo-1,3-dihydroindole-6-carboxylate
    Molecular Formula
    C10H9NO3
    Molecular Weight
    191.18  g/mol
    InChI Key
    YFTGUNWFFVDLNM-UHFFFAOYSA-N
    FDA UNII
    J55GEX7Z9Z
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    methyl 2-oxo-1,3-dihydroindole-6-carboxylate
    2.1.2 InChI
    InChI=1S/C10H9NO3/c1-14-10(13)7-3-2-6-5-9(12)11-8(6)4-7/h2-4H,5H2,1H3,(H,11,12)
    2.1.3 InChI Key
    YFTGUNWFFVDLNM-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    COC(=O)C1=CC2=C(CC(=O)N2)C=C1
    2.2 Other Identifiers
    2.2.1 UNII
    J55GEX7Z9Z
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 14192-26-8

    2. Methyl Oxindole-6-carboxylate

    3. Methyl 2-oxindole-6-carboxylate

    4. Methyl 2-oxoindole-6-carboxylate

    5. 1h-indole-6-carboxylic Acid, 2,3-dihydro-2-oxo-, Methyl Ester

    6. Methyl 2-oxo-1,3-dihydroindole-6-carboxylate

    7. Methyl 2-oxo-2,3-dihydro-1h-indole-6-carboxylate

    8. J55gex7z9z

    9. 6-methoxycarbonyl-2-oxindole

    10. Mfcd03095196

    11. 2-oxoindoline-6-carboxylic Acid Methyl Ester

    12. 2-oxindole-6-carboxylic Acid Methyl Ester

    13. 2-oxo-2,3-dihydro-1h-indole-6-carboxylic Acid Methyl Ester

    14. Unii-j55gex7z9z

    15. Ec 604-263-8

    16. 2-oxo-2,3-dihydro-1h-indol-6-carbonsauremethylester

    17. Schembl1359221

    18. Dtxsid50395695

    19. Methyl 2-oxoindolin-6-carboxylate

    20. Methyl2-oxoindoline-6-carboxylate

    21. Methyl-2-oxoindoline-6-carboxylate

    22. Act02460

    23. Bcp08566

    24. Cs-m2947

    25. Zinc2384046

    26. Cl3465

    27. Akos006345226

    28. Methyl 2-(2-oxoindolin-6-yl)acetate

    29. Pb30748

    30. Ps-5465

    31. 6-(methoxycarbonyl)-2-indolone

    32. Ac-22711

    33. Sy011926

    34. Db-042591

    35. Ft-0637027

    36. M2799

    37. O-6130

    38. Oxindole-6-carboxylic Acid Methyl Ester

    39. 192m268

    40. A807833

    41. Q-102643

    42. 2-oxoindoline-6-carboxylic Acid Methyl Ester;methyl 2-oxoindoline-6-carboxylate

    2.4 Create Date
    2005-09-10
    3 Chemical and Physical Properties
    Molecular Weight 191.18 g/mol
    Molecular Formula C10H9NO3
    XLogP30.6
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count3
    Rotatable Bond Count2
    Exact Mass191.058243149 g/mol
    Monoisotopic Mass191.058243149 g/mol
    Topological Polar Surface Area55.4 Ų
    Heavy Atom Count14
    Formal Charge0
    Complexity264
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1