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    Technical details about Corey lactone 4-phenylbenzoate, learn more about the structure, uses, toxicity, action, side effects and more

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    Corey lactone 4-phenylbenzoate

    APIs // Active Pharmaceutical Ingredients

    PRICE INFORMATION

    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: 31752-99-5, (-)-corey lactone 4-phenylbenzoate alcohol, Corey lactone 4-phenylbenzoate, (-)-corey lactone 5-(4-phenylbenzoate), [(3ar,4s,5r,6as)-4-(hydroxymethyl)-2-oxo-3,3a,4,5,6,6a-hexahydrocyclopenta[b]furan-5-yl] 4-phenylbenzoate, (-)-corey lactone 4-phenylbenzoate
    Molecular Formula
    C21H20O5
    Molecular Weight
    352.4  g/mol
    InChI Key
    SZJVIFMPKWMGSX-AKHDSKFASA-N
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    [(3aR,4S,5R,6aS)-4-(hydroxymethyl)-2-oxo-3,3a,4,5,6,6a-hexahydrocyclopenta[b]furan-5-yl] 4-phenylbenzoate
    2.1.2 InChI
    InChI=1S/C21H20O5/c22-12-17-16-10-20(23)25-18(16)11-19(17)26-21(24)15-8-6-14(7-9-15)13-4-2-1-3-5-13/h1-9,16-19,22H,10-12H2/t16-,17-,18+,19-/m1/s1
    2.1.3 InChI Key
    SZJVIFMPKWMGSX-AKHDSKFASA-N
    2.1.4 Canonical SMILES
    C1C2C(CC(=O)O2)C(C1OC(=O)C3=CC=C(C=C3)C4=CC=CC=C4)CO
    2.1.5 Isomeric SMILES
    C1[C@H]2[C@H](CC(=O)O2)[C@H]([C@@H]1OC(=O)C3=CC=C(C=C3)C4=CC=CC=C4)CO
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 31752-99-5

    2. (-)-corey Lactone 4-phenylbenzoate Alcohol

    3. Corey Lactone 4-phenylbenzoate

    4. (-)-corey Lactone 5-(4-phenylbenzoate)

    5. [(3ar,4s,5r,6as)-4-(hydroxymethyl)-2-oxo-3,3a,4,5,6,6a-hexahydrocyclopenta[b]furan-5-yl] 4-phenylbenzoate

    6. (-)-corey Lactone 4-phenylbenzoate

    7. (-)-corey Lactone,4-phenylbenzoate Alcohol

    8. Corey Lactone P-phenylbenzoate Alcohol

    9. (3ar,4s,5r,6as)-[1,1'-biphenyl]-4-carboxylic Acid, Hexahydro-4-(methoxymethyl)-2-oxo-2h-cyclopentafuran-5-yl Ester

    10. (-)-corey Lactone, 4-pbp

    11. Mfcd00078077

    12. (3ar,4s,5r,6as)-4-(hydroxymethyl)-2-oxohexahydro-2h-cyclopenta[b]furan-5-yl [1,1'-biphenyl]-4-carboxylate

    13. Timtec1_004986

    14. Schembl12013754

    15. Dtxsid00369124

    16. Hms1548c14

    17. Amy25117

    18. Zinc4261895

    19. Akos024438682

    20. Ac-6092

    21. (3ar,4s,5r,6as)-4-(hydroxymethyl)-2-oxohexahydro-2h-cyclopenta[b]furan-5-yl 4-phenylbenzoate

    22. Cs-11497

    23. Cs-0003840

    24. F20541

    25. 752c995

    26. A820979

    27. (-)-corey Lactone, 4-phenylbenzoate Alcohol, 99%

    28. Q5170469

    29. Biphenyl-4-carboxylic Acid 4-ho-methyl-2-oxo-6h-cyclopenta(b)furan-5-yl Ester

    30. (3ar,4s,5r,6as)-4-(hydroxymethyl)-2-oxohexahydro-2h-cyclopenta[b]furan-5-ylbiphenyl-4-carboxylate

    31. (3ar,4s,5r,6as)-hexahydro-4-(hydroxymethyl)-5-(4-phenylbenzoyloxy)-2h-cyclopenta[b]furan-2-one

    2.3 Create Date
    2005-07-19
    3 Chemical and Physical Properties
    Molecular Weight 352.4 g/mol
    Molecular Formula C21H20O5
    XLogP33.1
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count5
    Rotatable Bond Count5
    Exact Mass352.13107373 g/mol
    Monoisotopic Mass352.13107373 g/mol
    Topological Polar Surface Area72.8 Ų
    Heavy Atom Count26
    Formal Charge0
    Complexity519
    Isotope Atom Count0
    Defined Atom Stereocenter Count4
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
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