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    Menthoglycol

    PharmaCompass
    Xls

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    2D Structure
    Also known as: 42822-86-6, 2-(2-hydroxypropan-2-yl)-5-methylcyclohexan-1-ol, Para-menthane-3,8-diol, 3,8-p-menthanediol, Citriodiol, Geranodyle
    Molecular Formula
    C10H20O2
    Molecular Weight
    172.26  g/mol
    InChI Key
    LMXFTMYMHGYJEI-UHFFFAOYSA-N
    FDA UNII
    6T6Z1Z1NC4
    p-menthane-3,8-diol is a natural product found in Litsea cubeba, Corymbia citriodora, and Schisandra chinensis with data available.
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    2-(2-hydroxypropan-2-yl)-5-methylcyclohexan-1-ol
    2.1.2 InChI
    InChI=1S/C10H20O2/c1-7-4-5-8(9(11)6-7)10(2,3)12/h7-9,11-12H,4-6H2,1-3H3
    2.1.3 InChI Key
    LMXFTMYMHGYJEI-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CC1CCC(C(C1)O)C(C)(C)O
    2.2 Other Identifiers
    2.2.1 UNII
    6T6Z1Z1NC4
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. 2-(2'-hydroxypropan-2'-yl)-5-methylcyclohexanol

    2. 2-hydroxy-alpha,alpha,4-trimethylcyclohexanemethanol

    3. Geranodyle

    4. P-menthane-1,8-diol

    5. Para-menthane-3,8-diol

    6. Terpin

    7. Terpin Hydrate

    8. Terpin, Monohydrate(cis)-isomer

    9. Terpin, Titanium (+4) Salt

    2.3.2 Depositor-Supplied Synonyms

    1. 42822-86-6

    2. 2-(2-hydroxypropan-2-yl)-5-methylcyclohexan-1-ol

    3. Para-menthane-3,8-diol

    4. 3,8-p-menthanediol

    5. Citriodiol

    6. Geranodyle

    7. 2-(2-hydroxypropan-2-yl)-5-methylcyclohexanol

    8. Geranium Cyclohexane

    9. 2-hydroxy-alpha,alpha,4-trimethylcyclohexanemethanol

    10. 6t6z1z1nc4

    11. P-menthan-3,8-diol

    12. 2-(1-hydroxy-1-methylethyl)-5-methylcyclohexanol

    13. 8-hydroxymenthol

    14. Unii-6t6z1z1nc4

    15. Cubebaol

    16. Einecs 255-953-7

    17. Oil Of Lemon Eucalyptus

    18. Cyclohexanemethanol,2-hydroxy-a,a,4-trimethyl-

    19. 2-hydroxy-

    20. A,

    21. A,4-trimethylcyclohexanemethanol

    22. Citriodiol [who-dd]

    23. Schembl80731

    24. Amy584

    25. Dtxsid0035744

    26. Fema No. 4053

    27. Chebi:48250

    28. 1-hydroxy-2-(1-methyl-1-hydroxyethyl)-5-methylcyclohexane

    29. P-menthane-3,8-diol (natural)

    30. Cyclohexanemethanol, 2-hydroxy-.alpha.,.alpha.,4-trimethyl-

    31. Mfcd12756283

    32. Akos015902316

    33. P-menthane-3,8-diol [fhfi]

    34. Sb84527

    35. (+/-)-p-menthane-3,8-diol

    36. As-57135

    37. Da-05917

    38. Cis-1,3,trans-1,4-p-menthane-3,8-diol

    39. P-menthane-3,8-diol, (+/-)-

    40. (1alpha,3beta,4beta)-p-menthane-3,8-diol

    41. Cs-0152685

    42. Ft-0623947

    43. Ft-0770276

    44. 2-(2-hydroxy-2-propyl)-5-methyl-cyclohexanol

    45. F20699

    46. 2-hydroxy-a,a,4-trimethylcyclohexanemethanol, 9ci

    47. 822m866

    48. P-menthan-3,8-diol 100 Microg/ml In Acetonitrile

    49. Q3359470

    50. W-106259

    51. 2-hydroxy-alpha,alpha,4-trimethyl-cyclohexanemethanol

    52. Cyclohexanemethanol, 2-hydroxy-alpha,alpha,4-trimethyl-

    53. Cyclohexanemethanol,2-hydroxy-a,a,4-trimethyl-, (1r,2s,4r)-

    54. 1-hydroxy-5-methyl-2-(1-methyl-1-hydroxyethyl)cyclohexane

    2.4 Create Date
    2005-03-27
    3 Chemical and Physical Properties
    Molecular Weight 172.26 g/mol
    Molecular Formula C10H20O2
    XLogP32.2
    Hydrogen Bond Donor Count2
    Hydrogen Bond Acceptor Count2
    Rotatable Bond Count1
    Exact Mass172.146329876 g/mol
    Monoisotopic Mass172.146329876 g/mol
    Topological Polar Surface Area40.5 Ų
    Heavy Atom Count12
    Formal Charge0
    Complexity154
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count3
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
    4 Pharmacology and Biochemistry
    4.1 MeSH Pharmacological Classification

    Expectorants

    Agents that increase mucous excretion. Mucolytic agents, that is drugs that liquefy mucous secretions, are also included here. (See all compounds classified as Expectorants.)