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    Ethylenediamine Tetra-Methylenephosphonic Acid Pentasodiumsalt

    ACTIVE PHARMA INGREDIENTS

    PharmaCompass
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    2D Structure
    Also known as: 7651-99-2, Lexidronam pentasodium salt, Lexidronam pentasodium, Ethylenediamine tetra(methylenephosphonic acid) pentasodium salt, 2zyx2v82ad, Pentasodium;[2-[bis[[hydroxy(oxido)phosphoryl]methyl]amino]ethyl-(phosphonatomethyl)amino]methyl-hydroxyphosphinate
    Molecular Formula
    C6H15N2Na5O12P4
    Molecular Weight
    546.03  g/mol
    InChI Key
    QPTMDBQLCWRDCK-UHFFFAOYSA-I
    FDA UNII
    2ZYX2V82AD
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    pentasodium;[2-[bis[[hydroxy(oxido)phosphoryl]methyl]amino]ethyl-(phosphonatomethyl)amino]methyl-hydroxyphosphinate
    2.1.2 InChI
    InChI=1S/C6H20N2O12P4.5Na/c9-21(10,11)3-7(4-22(12,13)14)1-2-8(5-23(15,16)17)6-24(18,19)20;;;;;/h1-6H2,(H2,9,10,11)(H2,12,13,14)(H2,15,16,17)(H2,18,19,20);;;;;/q;5*+1/p-5
    2.1.3 InChI Key
    QPTMDBQLCWRDCK-UHFFFAOYSA-I
    2.1.4 Canonical SMILES
    C(CN(CP(=O)(O)[O-])CP(=O)([O-])[O-])N(CP(=O)(O)[O-])CP(=O)(O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+]
    2.2 Other Identifiers
    2.2.1 UNII
    2ZYX2V82AD
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 7651-99-2

    2. Lexidronam Pentasodium Salt

    3. Lexidronam Pentasodium

    4. Ethylenediamine Tetra(methylenephosphonic Acid) Pentasodium Salt

    5. 2zyx2v82ad

    6. Pentasodium;[2-[bis[[hydroxy(oxido)phosphoryl]methyl]amino]ethyl-(phosphonatomethyl)amino]methyl-hydroxyphosphinate

    7. Edtmp*na5

    8. Pentasodium Trihydrogen (ethane-1,2-diylbis(nitrilobis(methylene)))tetrakisphosphonate

    9. Phosphonic Acid, (1,2-ethanediylbis(nitrilobis(methylene)))tetrakis-, Pentasodium Salt

    10. Edtmp Pentasodium Salt

    11. Unii-2zyx2v82ad

    12. Einecs 231-615-4

    13. Ethylenediaminetetramethylenephosphonic Acid, Pentasodium Salt

    14. Methylene Phosphonnic Acid

    15. Pentasodium Ethylenediamine Tetramethylene Phosphonate

    16. Dtxsid4064763

    17. Mfcd03095541

    18. Akos025311031

    19. Phosphonic Acid, P,p',p'',p'''-(1,2-ethanediylbis(nitrilobis(methylene)))tetrakis-, Sodium Salt (1:5)

    20. Q27255875

    21. Ethylenediaminetetra(methylenephosphonicacid)pentasodiumsalt

    22. Pentasodium Ethylenediaminetetra(methylenephosphonate)

    23. Ethylenediamine Tetra(methylene Phosphonic Acid) Pentasodium Sal

    24. Ethylene Diamine Tetra (methylene Phosphonic Acid) Pentasodium Salt

    25. Pentasodium Ethylenediamine Tetramethylene Phosphonate [inci]

    26. Ethylene Diamine Tetra (methylene Phosphonic Acid) Pentasodium Salt (powder)

    27. Pentasodium Trihydrogen[ethane-1,2-diylbis[nitrilobis(methylene)]]tetrakisphosphonate

    2.4 Create Date
    2005-08-08
    3 Chemical and Physical Properties
    Molecular Weight 546.03 g/mol
    Molecular Formula C6H15N2Na5O12P4
    Hydrogen Bond Donor Count3
    Hydrogen Bond Acceptor Count14
    Rotatable Bond Count10
    Exact Mass545.9063933 g/mol
    Monoisotopic Mass545.9063933 g/mol
    Topological Polar Surface Area251 Ų
    Heavy Atom Count29
    Formal Charge0
    Complexity544
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count6