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    Tetrahydrozoline nitrate

    ACTIVE PHARMA INGREDIENTS

    PharmaCompass
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    2D Structure
    Also known as: 118201-38-0, Tetryzolin nitrate, Tetryzoline nitrate, Tetrahydrozoline nitrate [jan], (+/-)-tetrahydrozoline nitrate, 4,5-dihydro-2-(1,2,3,4-tetrahydro-1-naphthalenyl)-1h-imidazole mononitrate
    Molecular Formula
    C13H17N3O3
    Molecular Weight
    263.29  g/mol
    InChI Key
    SVQFLMKSDLCPAY-UHFFFAOYSA-N
    FDA UNII
    8P9X484T3F
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    nitric acid;2-(1,2,3,4-tetrahydronaphthalen-1-yl)-4,5-dihydro-1H-imidazole
    2.1.2 InChI
    InChI=1S/C13H16N2.HNO3/c1-2-6-11-10(4-1)5-3-7-12(11)13-14-8-9-15-13;2-1(3)4/h1-2,4,6,12H,3,5,7-9H2,(H,14,15);(H,2,3,4)
    2.1.3 InChI Key
    SVQFLMKSDLCPAY-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1CC(C2=CC=CC=C2C1)C3=NCCN3.[N+](=O)(O)[O-]
    2.2 Other Identifiers
    2.2.1 UNII
    8P9X484T3F
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 118201-38-0

    2. Tetryzolin Nitrate

    3. Tetryzoline Nitrate

    4. Tetrahydrozoline Nitrate [jan]

    5. (+/-)-tetrahydrozoline Nitrate

    6. 4,5-dihydro-2-(1,2,3,4-tetrahydro-1-naphthalenyl)-1h-imidazole Mononitrate

    7. Tetrahydrozoline Nitrate (jan)

    8. Tetrahydrozoline (nitrate)

    9. 8p9x484t3f

    10. 2-(1,2,3,4-tetrahydronaphthalen-1-yl)-4,5-dihydro-1h-imidazole Nitrate

    11. Nitric Acid;2-(1,2,3,4-tetrahydronaphthalen-1-yl)-4,5-dihydro-1h-imidazole

    12. 1h-imidazole, 4,5-dihydro-2-(1,2,3,4-tetrahydro-1-naphthalenyl)-, Mononitrate

    13. 1h-imidazole, 4,5-dihydro-2-(1,2,3,4-tetrahydro-1-naphthalenyl)-, Nitrate (1:1)

    14. Narbel

    15. Unii-8p9x484t3f

    16. Narbel (tn)

    17. Schembl1512892

    18. Chebi:145570

    19. Tetryzoline Nitrate [who-dd]

    20. Akos015895925

    21. D00756

    22. Q27270852

    2.4 Create Date
    2005-10-11
    3 Chemical and Physical Properties
    Molecular Weight 263.29 g/mol
    Molecular Formula C13H17N3O3
    Hydrogen Bond Donor Count2
    Hydrogen Bond Acceptor Count4
    Rotatable Bond Count1
    Exact Mass263.12699141 g/mol
    Monoisotopic Mass263.12699141 g/mol
    Topological Polar Surface Area90.4 Ų
    Heavy Atom Count19
    Formal Charge0
    Complexity284
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count1
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count2