Free Chemical Databases



  • [Synonyms]
    NSC155641
    [Structure]

    [ Properties Computed from Structure]
    Molecular Weight255.61168 [g/mol]
    Molecular FormulaC11H17Cl3
    XLogP6.3
    H-Bond Donor0
    H-Bond Acceptor0
    Rotatable Bond Count0
    Exact Mass254.039584
    MonoIsotopic Mass254.039584
    Topological Polar Surface Area0
    Heavy Atom Count14
    Formal Charge0
    Complexity197
    Isotope Atom Count0
    Defined Atom StereoCenter Count0
    Undefined Atom StereoCenter Count3
    Defined Bond StereoCenter Count0
    Undefined Bond StereoCenter Count0
    Covalently-Bonded Unit Count1

    [ Descriptors Computed from Structure]
    IUPAC Name: 1-(trichloromethyl)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene
    Canonical SMILES: C1CCC2C(C1)CCCC2C(Cl)(Cl)Cl
    InChI: InChI=1/C11H17Cl3/c12-11(13,14)10-7-3-5-8-4-1-2-6-9(8)10/h8-10H,1-7H2



Other Chemicals
.78125