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    Technical details about 3-Chloro-5-Acetyl-Iminodibenzyl, learn more about the structure, uses, toxicity, action, side effects and more

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    3-Chloro-5-Acetyl-Iminodibenzyl

    Manufacturers/Suppliers

    PharmaCompass

    Farmhispania Group, a leading European CDMO in HPAPI Technologies & High Potency Fermentation.

    One Pharma aims to be one of the leading generic companies in Europe.

    2D Structure
    1. Also known as: 25961-11-9, 3-chloro-5-acetyliminodibenzyl, 1-(3-chloro-10,11-dihydro-5h-dibenzo[b,f]azepin-5-yl)ethanone, 1-(2-chloro-5,6-dihydrobenzo[b][1]benzazepin-11-yl)ethanone, 5-acetyl-3-chloro-10,11-dihydrodibenzo[b,f]azepine, 5-acetyl-3-chloroiminodibenzyl
    Molecular Formula
    C16H14ClNO
    Molecular Weight
    271.74  g/mol
    InChI Key
    NMZOSOMVILZBJL-UHFFFAOYSA-N
    FDA UNII
    50MZ2KM0ZX
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    1-(2-chloro-5,6-dihydrobenzo[b][1]benzazepin-11-yl)ethanone
    2.1.2 InChI
    InChI=1S/C16H14ClNO/c1-11(19)18-15-5-3-2-4-12(15)6-7-13-8-9-14(17)10-16(13)18/h2-5,8-10H,6-7H2,1H3
    2.1.3 InChI Key
    NMZOSOMVILZBJL-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CC(=O)N1C2=CC=CC=C2CCC3=C1C=C(C=C3)Cl
    2.2 Other Identifiers
    2.2.1 UNII
    50MZ2KM0ZX
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 25961-11-9

    2. 3-chloro-5-acetyliminodibenzyl

    3. 1-(3-chloro-10,11-dihydro-5h-dibenzo[b,f]azepin-5-yl)ethanone

    4. 1-(2-chloro-5,6-dihydrobenzo[b][1]benzazepin-11-yl)ethanone

    5. 5-acetyl-3-chloro-10,11-dihydrodibenzo[b,f]azepine

    6. 5-acetyl-3-chloroiminodibenzyl

    7. 5-acetyl-3-chloro-10,11-dihydro-5h-dibenz(b,f)azepine

    8. 50mz2km0zx

    9. Mfcd01632170

    10. 5h-dibenz[b,f]azepine, 5-acetyl-3-chloro-10,11-dihydro-

    11. Ethanone, 1-(3-chloro-10,11-dihydro-5h-dibenz[b,f]azepin-5-yl)-

    12. Einecs 247-371-7

    13. 1-(3-chloro-10,11-dihydro-5h-dibenzo(b,f)azepin-5-yl)ethanone

    14. Ethanone, 1-(3-chloro-10,11-dihydro-5h-dibenz(b,f)azepin-5-yl)-

    15. Carbamazepine Impurity 1

    16. Unii-50mz2km0zx

    17. Chembl3580710

    18. 3-chloro-5-acetyl-iminodibenzyl

    19. Dtxsid30180627

    20. Bcp34514

    21. Zinc5160120

    22. Akos015900349

    23. Ac-3538

    24. Cs-w012364

    25. 5-acetyl-3-chloro-2,2'-iminodibenzyl

    26. As-15171

    27. Sy037118

    28. Ft-0645035

    29. H11317

    30. 961a119

    31. A818109

    32. J-650003

    33. J-650389

    34. 1-(3-chloro-10,11-dihydrodibenzo[b,f]azepin-5-yl)ethanone

    35. 3-chloro-5-acetyl-10,11-dihydro-dibenzo[b,f] Azepine

    36. 1-(2-chloranyl-5,6-dihydrobenzo[b][1]benzazepin-11-yl)ethanone

    37. 1-{14-chloro-2-azatricyclo[9.4.0.03]pentadeca-1(11),3,5,7,12,14-hexaen-2-yl}ethan-1-one

    38. 3-chloro-5-acetyliminodibenzyl;1-(3-chloro-10,11-dihydro-5h-dibenzo[b,f]azepin-5-yl)ethanone

    2.4 Create Date
    2005-08-08
    3 Chemical and Physical Properties
    Molecular Weight 271.74 g/mol
    Molecular Formula C16H14ClNO
    XLogP33.8
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count1
    Rotatable Bond Count0
    Exact Mass271.0763918 g/mol
    Monoisotopic Mass271.0763918 g/mol
    Topological Polar Surface Area20.3 Ų
    Heavy Atom Count19
    Formal Charge0
    Complexity346
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
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