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    Fenipentol

    PharmaCompass
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    2D Structure
    Also known as: 1-phenylpentan-1-ol, 1-phenyl-1-pentanol, 583-03-9, Pancoral, 1-phenylpentanol, Alpha-butylbenzyl alcohol
    Molecular Formula
    C11H16O
    Molecular Weight
    164.24  g/mol
    InChI Key
    OVGORFFCBUIFIA-UHFFFAOYSA-N
    FDA UNII
    X3FZE77O60
    -butylbenzyl alcohol is a natural product found in Vincetoxicum glaucescens with data available.
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    1-phenylpentan-1-ol
    2.1.2 InChI
    InChI=1S/C11H16O/c1-2-3-9-11(12)10-7-5-4-6-8-10/h4-8,11-12H,2-3,9H2,1H3
    2.1.3 InChI Key
    OVGORFFCBUIFIA-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CCCCC(C1=CC=CC=C1)O
    2.2 Other Identifiers
    2.2.1 UNII
    X3FZE77O60
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. 1-phenyl-1-hydroxy-n-pentane

    2. 1-phenyl-1-hydroxypentane

    3. 1-phnp

    4. Febichol

    5. Fenipentol, (r)-isomer

    6. Fenipentol, (s)-isomer

    2.3.2 Depositor-Supplied Synonyms

    1. 1-phenylpentan-1-ol

    2. 1-phenyl-1-pentanol

    3. 583-03-9

    4. Pancoral

    5. 1-phenylpentanol

    6. Alpha-butylbenzyl Alcohol

    7. Phenylbutylcarbinol

    8. Suiclisin

    9. 1-pentanol, 1-phenyl-

    10. 1-phenyl-1-hydroxypentane

    11. Ph Bc

    12. Benzenemethanol, .alpha.-butyl-

    13. 1-hydroxy-1-phenylpentane

    14. Pc 1

    15. Nsc 8478

    16. .alpha.-butylbenzyl Alcohol

    17. 1-phenyl-1-hydroxy-n-pentane

    18. Benzyl Alcohol, .alpha.-butyl-

    19. Ph-bc

    20. Nsc-8478

    21. .alpha.-butylbenzenemethanol

    22. X3fze77o60

    23. Fenipentolum

    24. Fenipentol [inn:jan]

    25. Alpha-butylbenzenemethanol

    26. Fenipentolum [inn-latin]

    27. Einecs 209-493-9

    28. Brn 1908761

    29. Unii-x3fze77o60

    30. Benzenemethanol, Alpha-butyl-

    31. Ai3-36514

    32. Benzyl Alcohol, Alpha-butyl-

    33. Ncgc00181036-01

    34. A-butylbenzylalcohol

    35. N-butyl Phenyl Carbinol

    36. 1-phenyl-pentan-1-ol

    37. Fenipentol [mi]

    38. Fenipentol (jan/inn)

    39. Fenipentol [inn]

    40. Fenipentol [jan]

    41. Fenipentol [mart.]

    42. Dsstox_cid_26818

    43. Dsstox_rid_81930

    44. Fenipentol [who-dd]

    45. Dsstox_gsid_46818

    46. Schembl21837

    47. 4-06-00-03371 (beilstein Handbook Reference)

    48. Chembl2104321

    49. Dtxsid4046818

    50. Chebi:31600

    51. Nsc8478

    52. Hms3713l06

    53. Hy-b1273

    54. Tox21_112684

    55. Mfcd00021935

    56. S5702

    57. Akos009158098

    58. (+/-)-1-phenyl-1-pentanol

    59. Ccg-213901

    60. Ncgc00344546-01

    61. As-76425

    62. Cas-583-03-9

    63. (+/-)-.alpha.-butylbenzyl Alcohol

    64. Cs-0013053

    65. Ft-0626398

    66. P1086

    67. D01751

    68. D92069

    69. Ab01563209_01

    70. A831823

    71. Q426345

    72. Sr-01000944264

    73. Sr-01000944264-1

    74. Brd-a66284731-001-01-2

    2.4 Create Date
    2005-03-25
    3 Chemical and Physical Properties
    Molecular Weight 164.24 g/mol
    Molecular Formula C11H16O
    XLogP32.9
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count1
    Rotatable Bond Count4
    Exact Mass164.120115130 g/mol
    Monoisotopic Mass164.120115130 g/mol
    Topological Polar Surface Area20.2 Ų
    Heavy Atom Count12
    Formal Charge0
    Complexity106
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count1
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
    4 Pharmacology and Biochemistry
    4.1 MeSH Pharmacological Classification

    Cholagogues and Choleretics

    Gastrointestinal agents that stimulate the flow of bile into the duodenum (cholagogues) or stimulate the production of bile by the liver (choleretic). (See all compounds classified as Cholagogues and Choleretics.)