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    BUILDING BLOCK

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    Chemistry

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    Also known as: 40566-97-0, 4-hydrazino-benzamide hcl, 4-hydrazinylbenzamide;hydrochloride, 4-hydrazino-benzamide hydrochloride, 4-hydrazinobenzamide hcl, Schembl980759
    Molecular Formula
    C7H10ClN3O
    Molecular Weight
    187.63  g/mol
    InChI Key
    FSBKBFIGWCHKLN-UHFFFAOYSA-N
    CAS 40566-97-0
    1 2D Structure

    CAS 40566-97-0

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    4-hydrazinylbenzamide;hydrochloride
    2.1.2 InChI
    InChI=1S/C7H9N3O.ClH/c8-7(11)5-1-3-6(10-9)4-2-5;/h1-4,10H,9H2,(H2,8,11);1H
    2.1.3 InChI Key
    FSBKBFIGWCHKLN-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1=CC(=CC=C1C(=O)N)NN.Cl
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 40566-97-0

    2. 4-hydrazino-benzamide Hcl

    3. 4-hydrazinylbenzamide;hydrochloride

    4. 4-hydrazino-benzamide Hydrochloride

    5. 4-hydrazinobenzamide Hcl

    6. Schembl980759

    7. 4-hydrazinylbenzamidehydrochloride

    8. Dtxsid70623381

    9. Act09689

    10. Mfcd20261430

    11. As-30011

    12. Cs-0209694

    13. 4-hydrazinylbenzamide--hydrogen Chloride (1/1)

    2.3 Create Date
    2007-12-05
    3 Chemical and Physical Properties
    Molecular Weight 187.63 g/mol
    Molecular Formula C7H10ClN3O
    Hydrogen Bond Donor Count4
    Hydrogen Bond Acceptor Count3
    Rotatable Bond Count2
    Exact Mass g/mol
    Monoisotopic Mass g/mol
    Topological Polar Surface Area81.1
    Heavy Atom Count12
    Formal Charge0
    Complexity141
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count2

    BUILDING BLOCK

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