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    1626482-00-5 manufacturers and suppliers on PharmaCompass

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    Ethyl (2S,3S)-3-aminobicyclo[2.2.2]octane-2-carboxylate

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    PharmaCompass
    Ethyl (2S,3S)-3-aminobicyclo[2.2.2]octane-2-carboxylate
    Also known as: 1626482-00-5, (2s,3s)-ethyl 3-aminobicyclo[2.2.2]octane-2-carboxylate, Schembl18053180, Schembl19320354, Zinc261038691, Cs-0184602
    Molecular Formula
    C11H19NO2
    Molecular Weight
    197.27  g/mol
    InChI Key
    CFRDVZHAVFJIFL-QLEHZGMVSA-N
    1 2D Structure

    Ethyl (2S,3S)-3-aminobicyclo[2.2.2]octane-2-carboxylate

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    ethyl (2S,3S)-3-aminobicyclo[2.2.2]octane-2-carboxylate
    2.1.2 InChI
    InChI=1S/C11H19NO2/c1-2-14-11(13)9-7-3-5-8(6-4-7)10(9)12/h7-10H,2-6,12H2,1H3/t7?,8?,9-,10-/m0/s1
    2.1.3 InChI Key
    CFRDVZHAVFJIFL-QLEHZGMVSA-N
    2.1.4 Canonical SMILES
    CCOC(=O)C1C2CCC(C1N)CC2
    2.1.5 Isomeric SMILES
    CCOC(=O)[C@@H]1[C@H](C2CCC1CC2)N
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 1626482-00-5

    2. (2s,3s)-ethyl 3-aminobicyclo[2.2.2]octane-2-carboxylate

    3. Schembl18053180

    4. Schembl19320354

    5. Zinc261038691

    6. Cs-0184602

    7. P16201

    8. (2s,3s)-ethyl3-aminobicyclo[2.2.2]octane-2-carboxylate

    2.3 Create Date
    2016-12-08
    3 Chemical and Physical Properties
    Molecular Weight 197.27 g/mol
    Molecular Formula C11H19NO2
    XLogP32
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count3
    Rotatable Bond Count3
    Exact Mass197.141578849 g/mol
    Monoisotopic Mass197.141578849 g/mol
    Topological Polar Surface Area52.3 Ų
    Heavy Atom Count14
    Formal Charge0
    Complexity221
    Isotope Atom Count0
    Defined Atom Stereocenter Count2
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
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      (1R,2S,3S,4R)-ethyl 3-aminobicyclo[2.2.2]octane-2-carbo...

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      1626482-00-5
      Pimodivir
      Shenzhen HwaGen Pharmaceutical Co., Ltd. (HwaGen Pharma) was founded in December of 2015 under the leader...
      Shenzhen HwaGen Pharmaceutical Co., Ltd. (HwaGen Pharma) was founded in December of 2015 under the leadership of a “National 1000 Talents Program” expert. By leveraging its core competency in chiral synthesis, enzymatic catalysis and continuous flow micro reactor, HwaGen Pharmaceutical is dedicated to development and manufacturing of specialty and niche intermediates and APIs covering various therapeutic areas including oncology, antiviral and respiratory, delivering high value-added and affordable products for global pharmaceutical industry. Equipments for Analysis & Test include Tabletop NMR, LC-MS, GC, HPLC etc.
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