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    CAS 42142-52-9

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    CAS 42142-52-9
    Also known as: 42142-52-9, 3-(methylamino)-1-phenylpropan-1-ol, Alpha-[2-(methylamino)ethyl]benzyl alcohol, 3-hydroxy-n-methyl-3-phenylpropylamine, 3-methylamino-1-phenylpropanol, 3-(methylamino)-1-phenyl-1-propanol
    Molecular Formula
    C10H15NO
    Molecular Weight
    165.23  g/mol
    InChI Key
    XXSDCGNHLFVSET-UHFFFAOYSA-N
    FDA UNII
    I28ND993BO
    1 2D Structure

    CAS 42142-52-9

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    3-(methylamino)-1-phenylpropan-1-ol
    2.1.2 InChI
    InChI=1S/C10H15NO/c1-11-8-7-10(12)9-5-3-2-4-6-9/h2-6,10-12H,7-8H2,1H3
    2.1.3 InChI Key
    XXSDCGNHLFVSET-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CNCCC(C1=CC=CC=C1)O
    2.2 Other Identifiers
    2.2.1 UNII
    I28ND993BO
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 42142-52-9

    2. 3-(methylamino)-1-phenylpropan-1-ol

    3. Alpha-[2-(methylamino)ethyl]benzyl Alcohol

    4. 3-hydroxy-n-methyl-3-phenylpropylamine

    5. 3-methylamino-1-phenylpropanol

    6. 3-(methylamino)-1-phenyl-1-propanol

    7. Atomoxetine Related Compound A

    8. I28nd993bo

    9. Mfcd00674078

    10. Alpha-(2-(methylamino)ethyl)benzyl Alcohol

    11. Alpha-[2-(methylamino)ethyl]benzenemethanol

    12. (1rs)-3-(methylamino)-1-phenylpropan-1-ol

    13. Einecs 255-679-8

    14. 3-methylamino-1-phenyl-propan-1-ol

    15. 3-(methylamino)-1-phenyl-propan-1-ol

    16. Unii-i28nd993bo

    17. N-methyl-3-hydroxy-3-phenyl-propylamine

    18. 3-methylamino-1-phenyl-1-propanol

    19. Fluoxetine Impurity A Crs

    20. Ec 255-679-8

    21. Schembl526622

    22. 3-methylamino-1-phenyl-propanol

    23. Dtxsid40866081

    24. 3-(methylamino)-1-phenylpropanol

    25. Act03342

    26. Bbl103097

    27. Stl556907

    28. N-methyl-3phenyl-3-hydroxypropylamine

    29. 1-phenyl-3-(methylamino)-1-propanol

    30. Akos005216445

    31. Akos016842442

    32. Gamma-hydroxy-n-methylphenylpropylamine

    33. Ab06932

    34. Ac-1834

    35. N-methyl-3-hydroxy-3-phenylpropylamine

    36. Sb76266

    37. Sb76272

    38. (+)-methylamino-1-phenyl-propan-1-ol

    39. 1-phenyl-3-(n-methylamino)propan-1-ol

    40. 3-hydroxy-n-methyl-3-phenyl Propylamine

    41. N-methyl-3-phenyl-3-hydroxypropyl-amine

    42. 1-phenyl-3-(n-methylamino)-propan-1-ol

    43. As-15329

    44. N-methyl-3-phenyl-3-hydroxy Propyl Amine

    45. N-methyl-3-phenyl-3-hydroxy-propyl-amine

    46. Sy050893

    47. Db-021724

    48. Alpha -[2-(methylamino)ethyl]benzyl Alcohol

    49. Cs-0010500

    50. Ft-0639765

    51. Ft-0771123

    52. Ft-0773467

    53. M1960

    54. (+/-)-n-methyl-3-hydroxy-3-phenylpropylamine

    55. 42h529

    56. Atomoxetine Related Compound A [usp-rs]

    57. F17750

    58. N-methyl-3-phenyl-3-hydroxypropylamine

    59. Alpha-[2-(methylamino)ethyl]benzyl Alcohol, 97%

    60. W-106283

    61. Atomoxetine Related Compound A [usp Impurity]

    62. Q27280280

    63. Benzenemethanol, .alpha.-(2-(methylamino)ethyl)-

    64. Atomoxetine Related Compound A, United States Pharmacopeia (usp) Reference Standard

    2.4 Create Date
    2005-07-19
    3 Chemical and Physical Properties
    Molecular Weight 165.23 g/mol
    Molecular Formula C10H15NO
    XLogP31
    Hydrogen Bond Donor Count2
    Hydrogen Bond Acceptor Count2
    Rotatable Bond Count4
    Exact Mass165.115364102 g/mol
    Monoisotopic Mass165.115364102 g/mol
    Topological Polar Surface Area32.3 Ų
    Heavy Atom Count12
    Formal Charge0
    Complexity110
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count1
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
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    Alembic Limited

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    3-chloro-1-phenylpropanol (3CPPA)

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    Established in 1907, Alembic Pharmaceuticals Limited is a leading pharmaceutical company in India. The Co...
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      3-Methylamino-1-Phenyl-1-Propanol

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        LUNA Chemicals Co.,Ltd. markets and manufactures world-class quality Active Pharmaceutical Ingredients and intermediate chemicals for generic pharmaceutical companies. Our Development Team focus strategically on the core therapeutic areas: cardiovascular, anti-depressant, allergic, healthcare and plant extraction. We provide technical support and efficient regulatory documentation for manufacturers, intellectual property(IP) was always carefully considered as well. We also provide excellent outsourcing services to customers and laboratory support.
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