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    Sodium hexametaphosphate (Na6P6O18)

    ACTIVE PHARMA INGREDIENTS

    MARKET PLACE

    PharmaCompass
    $ API Ref.Price (USD/KG) : 6Xls

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    2D Structure
    Also known as: Graham's salt, Hexasodium hexametaphosphate, Shmp, Sodium polymetaphosphate, Sodiumhexametaphosphate, N40n91dw96
    Molecular Formula
    Na6O18P6
    Molecular Weight
    611.77  g/mol
    InChI Key
    GCLGEJMYGQKIIW-UHFFFAOYSA-H
    FDA UNII
    N40N91DW96
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    hexasodium;2,4,6,8,10,12-hexaoxido-1,3,5,7,9,11-hexaoxa-25,45,65,85,105,125-hexaphosphacyclododecane 2,4,6,8,10,12-hexaoxide
    2.1.2 InChI
    InChI=1S/6Na.H6O18P6/c;;;;;;1-19(2)13-20(3,4)15-22(7,8)17-24(11,12)18-23(9,10)16-21(5,6)14-19/h;;;;;;(H,1,2)(H,3,4)(H,5,6)(H,7,8)(H,9,10)(H,11,12)/q6*+1;/p-6
    2.1.3 InChI Key
    GCLGEJMYGQKIIW-UHFFFAOYSA-H
    2.1.4 Canonical SMILES
    [O-]P1(=O)OP(=O)(OP(=O)(OP(=O)(OP(=O)(OP(=O)(O1)[O-])[O-])[O-])[O-])[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]
    2.2 Other Identifiers
    2.2.1 UNII
    N40N91DW96
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. Polymetaphosphate

    2. Sodium Hexametaphosphate

    3. Sodium Polymetaphosphate

    2.3.2 Depositor-Supplied Synonyms

    1. Graham's Salt

    2. Hexasodium Hexametaphosphate

    3. Shmp

    4. Sodium Polymetaphosphate

    5. Sodiumhexametaphosphate

    6. N40n91dw96

    7. Hexasodium;2,4,6,8,10,12-hexaoxido-1,3,5,7,9,11-hexaoxa-2lambda5,4lambda5,6lambda5,8lambda5,10lambda5,12lambda5-hexaphosphacyclododecane 2,4,6,8,10,12-hexaoxide

    8. Chemi-charl

    9. Medi-calgon

    10. Calgon S

    11. Calgon (old)

    12. Caswell No. 772

    13. Sodium Polymeta Phosphate

    14. Phosphate, Sodium Hexameta

    15. Hexametaphosphate, Sodium Salt

    16. Sodium Phosphate (na6p6o18)

    17. Fema 3027

    18. Hsdb 5053

    19. Natrium Hexametaphosphat [german]

    20. Einecs 233-343-1

    21. Metaphosphoric Acid, Hexasodium Salt

    22. Sodium Hexametaphosphate (na6p6o18)

    23. Epa Pesticide Chemical Code 076402

    24. Natrium Hexametaphosphat

    25. Metaphosphoric Acid (h6p6o18), Hexasodium Salt

    26. Unii-n40n91dw96

    27. Dtxsid1047522

    28. Hexasodium Cyclichexametaphosphate

    29. Hexasodium Metaphosphate (p6o186(-))

    30. Hexasodium Hexametaphosphate [hsdb]

    31. Sodium Hexametaphosphate (fragrance Grade)

    32. Sodium Hexametaphosphate (industrial Grade)

    33. Sodium Hexametaphosphate ((napo3)6)

    34. Ec 233-343-1

    35. Sodium Hexametaphosphate, Lr, >=67% P2o5 Basis

    36. Q3116769

    37. Shp

    2.4 Create Date
    2005-08-08
    3 Chemical and Physical Properties
    Molecular Weight 611.77 g/mol
    Molecular Formula Na6O18P6
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count18
    Rotatable Bond Count0
    Exact Mass611.6896508 g/mol
    Monoisotopic Mass611.6896508 g/mol
    Topological Polar Surface Area296 Ų
    Heavy Atom Count30
    Formal Charge0
    Complexity513
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count7