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    Technical details about CAS 99395-88-7, learn more about the structure, uses, toxicity, action, side effects and more

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    CAS 99395-88-7

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    2D Structure
    Also known as: 99395-88-7, (s)-4-phenyl-2-oxazolidinone, (s)-4-phenyloxazolidin-2-one, (4s)-4-phenyl-1,3-oxazolidin-2-one, 2-oxazolidinone, 4-phenyl-, (4s)-, 86217-38-1
    Molecular Formula
    C9H9NO2
    Molecular Weight
    163.17  g/mol
    InChI Key
    QDMNNMIOWVJVLY-MRVPVSSYSA-N
    FDA UNII
    DJ3K4V6J29
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    (4S)-4-phenyl-1,3-oxazolidin-2-one
    2.1.2 InChI
    InChI=1S/C9H9NO2/c11-9-10-8(6-12-9)7-4-2-1-3-5-7/h1-5,8H,6H2,(H,10,11)/t8-/m1/s1
    2.1.3 InChI Key
    QDMNNMIOWVJVLY-MRVPVSSYSA-N
    2.1.4 Canonical SMILES
    C1C(NC(=O)O1)C2=CC=CC=C2
    2.1.5 Isomeric SMILES
    C1[C@@H](NC(=O)O1)C2=CC=CC=C2
    2.2 Other Identifiers
    2.2.1 UNII
    DJ3K4V6J29
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 99395-88-7

    2. (s)-4-phenyl-2-oxazolidinone

    3. (s)-4-phenyloxazolidin-2-one

    4. (4s)-4-phenyl-1,3-oxazolidin-2-one

    5. 2-oxazolidinone, 4-phenyl-, (4s)-

    6. 86217-38-1

    7. (4s)-4-phenyloxazolidin-2-one

    8. (s)-poz

    9. Dj3k4v6j29

    10. (+)-4-phenyl-2-oxazolidinone

    11. (4s)-4-phenyl-2-oxazolidinone

    12. (s)-(+)-4-phenyloxazolidin-2-one

    13. 2-oxazolidinone, 4-phenyl-, (s)-

    14. Mfcd00043396

    15. (s)-4-phenyloxazolidinone

    16. Schembl4562

    17. Unii-dj3k4v6j29

    18. 4beta-phenyloxazolidine-2-one

    19. S-4-phenyl-oxazolidine-2-one

    20. (s)-4-phenyloxazoldin-2-one

    21. (s)-4-phenyl-oxazolidin-2-on

    22. (s)-4-phenyl-oxazolidin-2-one

    23. Dtxsid10912726

    24. S-(+)-4-phenyl-2-oxazolidinone

    25. Zinc143123

    26. Act07232

    27. Akos005259882

    28. (s)-(+)-4-phenyl-oxazolidin-2-one

    29. Ac-8429

    30. As-12030

    31. 4-phenyl-4,5-dihydro-1,3-oxazol-2-ol

    32. (s)-(+)-4-phenyl-2-oxazolidinone, 98%

    33. Am20060772

    34. Cs-0031471

    35. P1308

    36. (4s)-(+)-4-phenyl-1,3-oxazolidin-2-one

    37. 95p887

    38. A846016

    2.4 Create Date
    2005-07-08
    3 Chemical and Physical Properties
    Molecular Weight 163.17 g/mol
    Molecular Formula C9H9NO2
    XLogP31.2
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count2
    Rotatable Bond Count1
    Exact Mass163.063328530 g/mol
    Monoisotopic Mass163.063328530 g/mol
    Topological Polar Surface Area38.3 Ų
    Heavy Atom Count12
    Formal Charge0
    Complexity175
    Isotope Atom Count0
    Defined Atom Stereocenter Count1
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1