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    Technical details about CAS 19395-41-6, learn more about the structure, uses, toxicity, action, side effects and more

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    CAS 19395-41-6

    BUILDING BLOCK

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    2D Structure
    Also known as: 19395-41-6, 2-phenyl-2-(piperidin-2-yl)acetic acid, Phenyl(piperidin-2-yl)acetic acid, 2-phenyl-2-piperidin-2-ylacetic acid, Phenyl(2-piperidinyl)acetic acid, 2-phenyl-2-(2-piperidyl)acetic acid
    Molecular Formula
    C13H17NO2
    Molecular Weight
    219.28  g/mol
    InChI Key
    INGSNVSERUZOAK-UHFFFAOYSA-N
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    2-phenyl-2-piperidin-2-ylacetic acid
    2.1.2 InChI
    InChI=1S/C13H17NO2/c15-13(16)12(10-6-2-1-3-7-10)11-8-4-5-9-14-11/h1-3,6-7,11-12,14H,4-5,8-9H2,(H,15,16)
    2.1.3 InChI Key
    INGSNVSERUZOAK-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1CCNC(C1)C(C2=CC=CC=C2)C(=O)O
    2.2 Synonyms
    2.2.1 MeSH Synonyms

    1. Alpha-phenyl-2-piperidineacetic Acid

    2. Ritalinic Acid, (r*,r*)-(+-)-isomer

    2.2.2 Depositor-Supplied Synonyms

    1. 19395-41-6

    2. 2-phenyl-2-(piperidin-2-yl)acetic Acid

    3. Phenyl(piperidin-2-yl)acetic Acid

    4. 2-phenyl-2-piperidin-2-ylacetic Acid

    5. Phenyl(2-piperidinyl)acetic Acid

    6. 2-phenyl-2-(2-piperidyl)acetic Acid

    7. Alpha-phenyl-2-piperidineacetic Acid

    8. Alpha-phenylpiperidine-2-acetic Acid

    9. Mfcd06200695

    10. Dl-threo-ritalinic Acidsee R533110

    11. 2-phenyl-2-piperidineacetic Acid

    12. 54631-24-2

    13. Einecs 243-020-7

    14. 2-phenyl-2-(2-piperidyl) Acetic Acid

    15. Ritalinic Acid, 99% (cp)

    16. Schembl1462581

    17. Chebi:83481

    18. Dtxsid20864888

    19. Ritalinic Acid, Analytical Standard

    20. Bcp07811

    21. Bcp26035

    22. Phenyl(2-piperidinyl)acetic Acid #

    23. S5251

    24. Akos015892837

    25. 2-piperidineacetic Acid, Alpha-phenyl-

    26. Ac-8122

    27. Cs-w022954

    28. Fs-3198

    29. 2-phenyl-2-piperidineacetic Acid, 98%

    30. Sy030346

    31. Db-014888

    32. Ft-0653505

    33. Ft-0674435

    34. Ft-0674438

    35. Ft-0674439

    36. Ft-0674440

    37. Ft-0674441

    38. Ft-0674442

    39. Ft-0674443

    40. R0111

    41. A19443

    42. 395r416

    43. Q17052328

    44. Phenyl(2-piperidinyl)acetic Acid;2-phenyl-2-piperidineacetic Acid

    45. L-threo-ritalinic Acid;(2s)-2-phenyl-2-[(s)-2-piperidinyl]acetic Acid

    2.3 Create Date
    2005-03-27
    3 Chemical and Physical Properties
    Molecular Weight 219.28 g/mol
    Molecular Formula C13H17NO2
    XLogP3-2.4
    Hydrogen Bond Donor Count2
    Hydrogen Bond Acceptor Count3
    Rotatable Bond Count3
    Exact Mass219.125928785 g/mol
    Monoisotopic Mass219.125928785 g/mol
    Topological Polar Surface Area49.3 Ų
    Heavy Atom Count16
    Formal Charge0
    Complexity236
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count2
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1