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    Chemistry

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    Also known as: 90038-01-0, Detomidine hcl, Domosedan, Mpv-253 aii, Detomidine hydrochloride [usan], Detomidine (hydrochloride)
    Molecular Formula
    C12H15ClN2
    Molecular Weight
    222.71  g/mol
    InChI Key
    OIWRDXKNDCJZSM-UHFFFAOYSA-N
    FDA UNII
    95K4LKB6QE
    Detomidine
    1 2D Structure

    Detomidine

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    5-[(2,3-dimethylphenyl)methyl]-1H-imidazole;hydrochloride
    2.1.2 InChI
    InChI=1S/C12H14N2.ClH/c1-9-4-3-5-11(10(9)2)6-12-7-13-8-14-12;/h3-5,7-8H,6H2,1-2H3,(H,13,14);1H
    2.1.3 InChI Key
    OIWRDXKNDCJZSM-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CC1=C(C(=CC=C1)CC2=CN=CN2)C.Cl
    2.2 Other Identifiers
    2.2.1 UNII
    95K4LKB6QE
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. Detomidine

    2. Detomidine Monohydrochloride

    2.3.2 Depositor-Supplied Synonyms

    1. 90038-01-0

    2. Detomidine Hcl

    3. Domosedan

    4. Mpv-253 Aii

    5. Detomidine Hydrochloride [usan]

    6. Detomidine (hydrochloride)

    7. 5-(2,3-dimethylbenzyl)-1h-imidazole Hydrochloride

    8. 5-[(2,3-dimethylphenyl)methyl]-1h-imidazole Hydrochloride

    9. 4-(2,3-dimethylbenzyl)imidazole Monohydrochloride

    10. 95k4lkb6qe

    11. 1h-imidazole, 4-[(2,3-dimethylphenyl)methyl]-, Monohydrochloride

    12. 4-(2,3-dimethylbenzyl)-1h-imidazole Hydrochloride

    13. Mfcd17292784

    14. 1h-imidazole, 4-((2,3-dimethylphenyl)methyl)-, Monohydrochloride

    15. 5-(2,3-dimethylbenzyl)imidazole Hydrochloride

    16. Dsstox_cid_28587

    17. Dsstox_rid_82858

    18. 4-(2,3-dimethylbenzyl)-1h-imidazole Hcl

    19. Dsstox_gsid_48661

    20. Detomidine Hydrochloride (usan)

    21. 5-[(2,3-dimethylphenyl)methyl]-1h-imidazole;hydrochloride

    22. Cas-90038-01-0

    23. Ncgc00182057-02

    24. Unii-95k4lkb6qe

    25. 4-[(2,3-dimethylphenyl)methyl]-1h-imidazole;hydrochloride

    26. 4-(2',3'-dimethylbenzyl)imidazole Hydrochloride

    27. 4-((2,3-dimethylphenyl)methyl)-1h-imidazole Hydrochloride

    28. Schembl203174

    29. Chembl2106210

    30. Dtxsid7048661

    31. Hy-b0163a

    32. Amy6987

    33. Bcp06805

    34. Tox21_113020

    35. Ac-309

    36. Detomidine Hydrochloride [mi]

    37. S2092

    38. Akos024464193

    39. Akos025149295

    40. Tox21_113020_1

    41. As-2744

    42. Ccg-266742

    43. Cs-1996

    44. Sb39723

    45. Detomidine Hydrochloride [mart.]

    46. Ncgc00182057-03

    47. Sy046831

    48. D4331

    49. Detomidine Hydrochloride [green Book]

    50. Ft-0666296

    51. Sw219456-1

    52. D03702

    53. 4-[(2,3-dimethylbenzyl)]imidazole Hydrochloride

    54. 038d010

    55. 5-[(2,3-dimethylphenyl)methyl]-1h-imidazole Hcl

    56. A854060

    57. Detomidine Hydrochloride For Veterinary Use

    58. 4-(2'',3''-dimethylbenzyl)imidazole Hydrochloride

    59. J-516575

    60. Q27271799

    61. 4-(2,3-dimethylbenzyl)-1h-imidazole Hydrochloride (1:1)

    62. 4-[(2,3-dimethylphenyl)methyl]-3h-imidazole Hydrochloride

    63. Detomidine Hydrochloride For Veterinary Use [ep Monograph]

    64. Detomidine Hydrochloride; Mpv-253 Hcl; Mpv 253 Hcl; Mpv253 Hcl

    65. 4-[(2,3-dimethylphenyl)methyl]-1h-imidazole Monohydrochloride;detomidine Hcl

    2.4 Create Date
    2005-08-08
    3 Chemical and Physical Properties
    Molecular Weight 222.71 g/mol
    Molecular Formula C12H15ClN2
    Hydrogen Bond Donor Count2
    Hydrogen Bond Acceptor Count1
    Rotatable Bond Count2
    Exact Mass222.0923762 g/mol
    Monoisotopic Mass222.0923762 g/mol
    Topological Polar Surface Area28.7 Ų
    Heavy Atom Count15
    Formal Charge0
    Complexity181
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count2
    4 Pharmacology and Biochemistry
    4.1 MeSH Pharmacological Classification

    Adrenergic alpha-2 Receptor Agonists

    Compounds that bind to and activate ADRENERGIC ALPHA-2 RECEPTORS. (See all compounds classified as Adrenergic alpha-2 Receptor Agonists.)

    Hypnotics and Sedatives

    Drugs used to induce drowsiness or sleep or to reduce psychological excitement or anxiety. (See all compounds classified as Hypnotics and Sedatives.)

    Analgesics

    Compounds capable of relieving pain without the loss of CONSCIOUSNESS. (See all compounds classified as Analgesics.)

    API Reference Price

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    27-Mar-2021
    01-Aug-2024
    KGS
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    (USD/KGS)    		 Number of Transactions

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