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    Methyl 2R 3S-3-4-Methoxyphenyl-Oxirane-2-Carboxylate

    ACTIVE PHARMA INGREDIENTS

    PharmaCompass
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    2D Structure
    Also known as: 105560-93-8, Methyl (2r,3s)-2,3-epoxy-3-(4-methoxyphenyl)propronate, D8mq7l5pj2, (2r,3s)-methyl 3-(4-methoxyphenyl)oxirane-2-carboxylate, Methyl (2r,3s)-3-(4-methoxyphenyl)oxirane-2-carboxylate, Methyl 2,3-epoxy-3-(4-methoxyphenyl)propionate, (2r,3s)-(-)-
    Molecular Formula
    C11H12O4
    Molecular Weight
    208.21  g/mol
    InChI Key
    CVZUMGUZDAWOGA-VHSXEESVSA-N
    FDA UNII
    D8MQ7L5PJ2
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    methyl (2R,3S)-3-(4-methoxyphenyl)oxirane-2-carboxylate
    2.1.2 InChI
    InChI=1S/C11H12O4/c1-13-8-5-3-7(4-6-8)9-10(15-9)11(12)14-2/h3-6,9-10H,1-2H3/t9-,10+/m0/s1
    2.1.3 InChI Key
    CVZUMGUZDAWOGA-VHSXEESVSA-N
    2.1.4 Canonical SMILES
    COC1=CC=C(C=C1)C2C(O2)C(=O)OC
    2.1.5 Isomeric SMILES
    COC1=CC=C(C=C1)[C@H]2[C@@H](O2)C(=O)OC
    2.2 Other Identifiers
    2.2.1 UNII
    D8MQ7L5PJ2
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. 3-(-methoxyphenyl)glycidic Acid Methylester

    2. Methyl (2r,3s)-3-(4-methoxyphenyl)glycidate

    3. Methyl 2,3-epoxy-3-(4-methoxyphenyl)propionate

    4. Methyl 3-(4-methoxyphenyl)glycidate

    5. Methyl-3-(4-methoxyphenyl)glycidate

    6. T-methyl-3-phenylglycidate

    2.3.2 Depositor-Supplied Synonyms

    1. 105560-93-8

    2. Methyl (2r,3s)-2,3-epoxy-3-(4-methoxyphenyl)propronate

    3. D8mq7l5pj2

    4. (2r,3s)-methyl 3-(4-methoxyphenyl)oxirane-2-carboxylate

    5. Methyl (2r,3s)-3-(4-methoxyphenyl)oxirane-2-carboxylate

    6. Methyl 2,3-epoxy-3-(4-methoxyphenyl)propionate, (2r,3s)-(-)-

    7. Oxiranecarboxylic Acid, 3-(4-methoxyphenyl)-, Methyl Ester, (2r,3s)-rel-

    8. 84056-02-0

    9. 96125-49-4

    10. Methyl Trans-3-(4-methoxyphenyl)glycidate

    11. Unii-d8mq7l5pj2

    12. Methyl 2r,3s-(-)-3-(4-methoxyphenyl)oxiranecarboxylate

    13. Schembl3201279

    14. Cvzumguzdawoga-vhsxeesvsa-

    15. Dtxsid40232949

    16. Zinc120420

    17. Albb-031368

    18. Mfcd06658225

    19. Akos015904393

    20. Ac-22558

    21. Ls-11349

    22. Cs-0339560

    23. Methyl (2r,3s)-3-(4-methoxyphenyl)glycidate

    24. Ec 404-130-2

    25. 560m938

    26. Methyl 3-(4-methoxyphenyl)-2-oxiranecarboxylate #

    27. (2r,3s)-3-(4-methoxyphenyl) Glycidic Acid Methyl Ester

    28. (2r,3s)-3-(4-methoxyphenyl)glycidic Acid Methyl Ester

    29. Glycidic Acid, Trans-3-[4-methoxyphenyl]-, Methyl Ester

    30. Methyl (2r,3s)-2,3-epoxy-3-(4-methoxyphenyl) Propronate

    31. Methyl 3-(4-methoxyphenyl)glycidate, Trans-(-)-

    32. Methyl (-)-(2r,3s)-2,3-epoxy-3-(4-methoxyphenyl)propionate

    33. (2r,3s)-3-(4-methoxyphenyl)-2,3-epoxypropionic Acid Methyl Ester

    34. 3alpha-(4-methoxyphenyl)oxirane-2beta-carboxylic Acid Methyl Ester

    35. Methyl (-) (2r,3s) 3-(4-methoxyphenyl)-2,3-epoxy-propionate

    36. Methyl (2r,3s)-3-(4-methoxyphenyl)-2,3-epoxypropionate

    37. Oxiranecarboxylic Acid, 3-(4-methoxyphenyl)-, Methyl Ester, (2r,3s)-

    38. Oxiranecarboxylic Acid, 3-(4-methoxyphenyl)-, Methyl Ester, (2r-trans)-

    2.4 Create Date
    2005-07-08
    3 Chemical and Physical Properties
    Molecular Weight 208.21 g/mol
    Molecular Formula C11H12O4
    XLogP31.3
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count4
    Rotatable Bond Count4
    Exact Mass208.07355886 g/mol
    Monoisotopic Mass208.07355886 g/mol
    Topological Polar Surface Area48.1 Ų
    Heavy Atom Count15
    Formal Charge0
    Complexity233
    Isotope Atom Count0
    Defined Atom Stereocenter Count2
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1