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    Technical details about CAS 1354486-07-9, learn more about the structure, uses, toxicity, action, side effects and more

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    CAS 1354486-07-9

    BUILDING BLOCK

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    2D Structure
    Also known as: 1354486-07-9, 477600-68-3, (3s,4s)-1-benzyl-n,4-dimethylpiperidin-3-amine;dihydrochloride, Cis-n-benzyl-3-methylamino-4-methyl-piperidine dihydrochloride, Cis-1-benzyl-3-(methylamino)-4-methylpiperidine dihcl, Mfcd09864744
    Molecular Formula
    C14H24Cl2N2
    Molecular Weight
    291.3  g/mol
    InChI Key
    CVQNXCBXFOIHLH-CIKMBUIBSA-N
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    (3S,4S)-1-benzyl-N,4-dimethylpiperidin-3-amine;dihydrochloride
    2.1.2 InChI
    InChI=1S/C14H22N2.2ClH/c1-12-8-9-16(11-14(12)15-2)10-13-6-4-3-5-7-13;;/h3-7,12,14-15H,8-11H2,1-2H3;2*1H/t12-,14+;;/m0../s1
    2.1.3 InChI Key
    CVQNXCBXFOIHLH-CIKMBUIBSA-N
    2.1.4 Canonical SMILES
    CC1CCN(CC1NC)CC2=CC=CC=C2.Cl.Cl
    2.1.5 Isomeric SMILES
    C[C@H]1CCN(C[C@H]1NC)CC2=CC=CC=C2.Cl.Cl
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 1354486-07-9

    2. 477600-68-3

    3. (3s,4s)-1-benzyl-n,4-dimethylpiperidin-3-amine;dihydrochloride

    4. Cis-n-benzyl-3-methylamino-4-methyl-piperidine Dihydrochloride

    5. Cis-1-benzyl-3-(methylamino)-4-methylpiperidine Dihcl

    6. Mfcd09864744

    7. Schembl2148084

    8. Dtxsid50716624

    9. Amy36803

    10. Cs-m1988

    11. Mfcd11841111

    12. Akos015844889

    13. Akos015894598

    14. Af-0011

    15. P11197

    16. (3s,4s)-1-benzyl-n,4-dimethylpiperidin-3-amine 2hcl

    17. (3s,4s)-1-benzyl-n,4-dimethylpiperidin-3-amine Dihcl

    18. (3s,4s)-1-benzyl-n,4-dimethylpiperidin-3-aminedihydrochloride

    19. (3s,4s)-1-benzyl-n,4-dimethylpiperidin-3-amine--hydrogen Chloride (1/2)

    20. 3-piperidinamine, N,4-dimethyl-1-(phenylmethyl)-, Dihydrochloride,(3r,4r)-rel-

    21. Racemic Cis-(1-benzyl-4-methyl-piperidine-3-yl)-methylamine Bis Hydrochloride

    2.3 Create Date
    2012-01-11
    3 Chemical and Physical Properties
    Molecular Weight 291.3 g/mol
    Molecular Formula C14H24Cl2N2
    Hydrogen Bond Donor Count3
    Hydrogen Bond Acceptor Count2
    Rotatable Bond Count3
    Exact Mass290.1316542 g/mol
    Monoisotopic Mass290.1316542 g/mol
    Topological Polar Surface Area15.3 Ų
    Heavy Atom Count18
    Formal Charge0
    Complexity199
    Isotope Atom Count0
    Defined Atom Stereocenter Count2
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count3