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    1-Benzylpiperidine-4-carbaldehyde

    BUILDING BLOCK

    MARKET PLACE

    PharmaCompass
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    2D Structure
    Also known as: 22065-85-6, 1-benzyl-4-piperidinecarboxaldehyde, N-benzylpiperidine-4-carboxaldehyde, 1-benzylpiperidine-4-carboxaldehyde, 1-benzyl-4-formylpiperidine, N-benzyl piperidine-4-carboxaldehyde
    Molecular Formula
    C13H17NO
    Molecular Weight
    203.28  g/mol
    InChI Key
    SGIBOXBBPQRZDM-UHFFFAOYSA-N
    FDA UNII
    S5RKG3HX5A
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    1-benzylpiperidine-4-carbaldehyde
    2.1.2 InChI
    InChI=1S/C13H17NO/c15-11-13-6-8-14(9-7-13)10-12-4-2-1-3-5-12/h1-5,11,13H,6-10H2
    2.1.3 InChI Key
    SGIBOXBBPQRZDM-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1CN(CCC1C=O)CC2=CC=CC=C2
    2.2 Other Identifiers
    2.2.1 UNII
    S5RKG3HX5A
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 22065-85-6

    2. 1-benzyl-4-piperidinecarboxaldehyde

    3. N-benzylpiperidine-4-carboxaldehyde

    4. 1-benzylpiperidine-4-carboxaldehyde

    5. 1-benzyl-4-formylpiperidine

    6. N-benzyl Piperidine-4-carboxaldehyde

    7. 1-benzyl-piperidine-4-carbaldehyde

    8. 1-benzyl-4-piperidine-carboxaldehyde

    9. 4-piperidinecarboxaldehyde, 1-(phenylmethyl)-

    10. N-benzyl-4-formylpiperidine

    11. S5rkg3hx5a

    12. 1-benzyl-4-piperidinecarbaldehyde

    13. Mfcd02258902

    14. Unii-s5rkg3hx5a

    15. 4-formyl-n-benzylpiperidine

    16. Schembl700085

    17. Dtxsid20176554

    18. 1-benylpiperidine-4-carboxaldehyde

    19. 1-benzyl-4- Piperidinecarbaldehyde

    20. 4-formyl-1-benzylpiperidine

    21. Act08762

    22. Albb-006394

    23. Zinc2579305

    24. Einecs 244-757-7

    25. N-benzy-4-piperidine Carboxaldehyde

    26. 1-benzyl 4-piperidine Carboxaldehyde

    27. Stk400094

    28. 1-benzyl-4-piperidine Carboxyaldehyde

    29. (1-benzyl)piperidine-4-carboxaldehyde

    30. Akos005453472

    31. Ab11696

    32. Ac-2104

    33. Cs-w007806

    34. N-benzylpiperidine-4-carbaldehyde

    35. 1-(phenylmethyl)-4-piperidinecarbaldehyde

    36. As-14903

    37. Sy009110

    38. N-benzyl-4-piperidinecarboxaldehyde

    39. N-benzylpiperidine-4-carboxaldehyde, 95%

    40. Db-011840

    41. 4-piperidinecarboxaldehyde, 1-(phenylmethyl)

    42. A4748

    43. Am20050357

    44. B3190

    45. Bb 0262314

    46. Ft-0638180

    47. 1-benzyl- 4-piperidine Carboxyaldehyde

    48. 065b856

    49. Sr-01000944871

    50. 1-(phenylmethyl)-4-piperidinecarboxaldehyde

    51. Q-201450

    52. Sr-01000944871-1

    2.4 Create Date
    2005-08-08
    3 Chemical and Physical Properties
    Molecular Weight 203.28 g/mol
    Molecular Formula C13H17NO
    XLogP31.7
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count2
    Rotatable Bond Count3
    Exact Mass203.131014166 g/mol
    Monoisotopic Mass203.131014166 g/mol
    Topological Polar Surface Area20.3 Ų
    Heavy Atom Count15
    Formal Charge0
    Complexity191
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1