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    Also known as: 14396-16-8, Piperazine 2-hydroxypropane-1,2,3-tricarboxylate, 2-hydroxypropane-1,2,3-tricarboxylic acid;piperazine, Piperazinecitrate, Oxyzin (syrup), Piperazine citrate (1:1)
    Molecular Formula
    C10H18N2O7
    Molecular Weight
    278.26  g/mol
    InChI Key
    SWDXALWLRYIJHK-UHFFFAOYSA-N
    Piperazine Citrate
    1 2D Structure

    Piperazine Citrate

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    2-hydroxypropane-1,2,3-tricarboxylic acid;piperazine
    2.1.2 InChI
    InChI=1S/C6H8O7.C4H10N2/c7-3(8)1-6(13,5(11)12)2-4(9)10;1-2-6-4-3-5-1/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);5-6H,1-4H2
    2.1.3 InChI Key
    SWDXALWLRYIJHK-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1CNCCN1.C(C(=O)O)C(CC(=O)O)(C(=O)O)O
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 14396-16-8

    2. Piperazine 2-hydroxypropane-1,2,3-tricarboxylate

    3. 2-hydroxypropane-1,2,3-tricarboxylic Acid;piperazine

    4. Piperazinecitrate

    5. Oxyzin (syrup)

    6. Piperazine Citrate (1:1)

    7. Schembl125278

    8. Dtxsid20921081

    9. Amy40769

    10. Nsc86779

    11. Piperazine Compound With Citric Acid

    12. Nsc203336

    13. Akos015920444

    14. Gs-3869

    15. Nsc-203336

    16. Piperazine,2,3-propanetricarboxylate (3:2)

    17. E75921

    18. A808202

    19. 2-hydroxypropane-1,2,3-tricarboxylic Acid--piperazine (1/1)

    20. Wln: T6m Dmtj & 3 & 622 & Qv1xqvq1vq & 2 & 621

    21. 113484-97-2

    2.3 Create Date
    2005-03-26
    3 Chemical and Physical Properties
    Molecular Weight 278.26 g/mol
    Molecular Formula C10H18N2O7
    Hydrogen Bond Donor Count6
    Hydrogen Bond Acceptor Count9
    Rotatable Bond Count5
    Exact Mass278.11140092 g/mol
    Monoisotopic Mass278.11140092 g/mol
    Topological Polar Surface Area156 Ų
    Heavy Atom Count19
    Formal Charge0
    Complexity254
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count2

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    02-Jan-2021
    28-Aug-2024
    KGS
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