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  • [Synonyms]
    2-Aminobenzylamine
    Ambap3609
    2-(Aminomethyl)aniline
    Benzenemethanamine, 2-amino-
    348015_ALDRICH
    InChI=1/C7H10N2/c8-5-6-3-1-2-4-7(6)9/h1-4H,5,8-9H

    [Structure]

    [ Properties Computed from Structure]
    Molecular Weight122.1677 [g/mol]
    Molecular FormulaC7H10N2
    XLogP0.3
    H-Bond Donor2
    H-Bond Acceptor2
    Rotatable Bond Count1
    Exact Mass122.084398
    MonoIsotopic Mass122.084398
    Topological Polar Surface Area52
    Heavy Atom Count9
    Formal Charge0
    Complexity83
    Isotope Atom Count0
    Defined Atom StereoCenter Count0
    Undefined Atom StereoCenter Count0
    Defined Bond StereoCenter Count0
    Undefined Bond StereoCenter Count0
    Covalently-Bonded Unit Count1

    [ Descriptors Computed from Structure]
    IUPAC Name: 2-(aminomethyl)aniline
    Canonical SMILES: C1=CC=C(C(=C1)CN)N
    InChI: InChI=1/C7H10N2/c8-5-6-3-1-2-4-7(6)9/h1-4H,5,8-9H2



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