Fosfructose Trisodium

Overview IFRA Request a quote

  • Identifiers

    CAS number
    81028-91-3

    Molecular formula
    C6H27Na3O20P2

    SMILES
    [H+].C([C@H]([C@H]([C@@H](C(=O)COP(=O)([O-])[O-])O)O)O)OP(=O)([O-])[O-].O.O.O.O.O.O.O.O.[Na+].[Na+].[Na+]

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  • Odor profile

    Fragrance
    Odorless 93.73%
    Bitter 14.99%
    Sharp 11.81%
    Clean 11.17%
    Sour 9.51%
    Malty 9.36%
    Sweaty 8.86%
    Fresh 8.8%
    Fishy 8.35%
    Savory 8.29%

     

    Flavor
    Odorless 62.11%
    Sour 26.54%
    Pungent 26.19%
    Vinegar 24.71%
    Rotten 22.95%
    Formyl 22.32%
    Bland 22.26%
    Mousy 21.98%
    Decomposing cabbage 20.86%
    Soy 20.73%

     

  • Properties

    pKa est.
    22.06 (strong base)

    Molecular weight
    550.18 g/mol

    Flash point

    • -96.1 ˚C est.

  • Synonyms

    • Fosfructose trisodium
    • 81028-91-3
    • 463VBZ2YVD
    • Fosfructose trisodium [USAN]
    • CPC-111
    • UNII-463VBZ2YVD
    • FOSFRUCTOSE TRISODIUM [MART.]
    • FOSFRUCTOSE TRISODIUM [WHO-DD]
    • D-Fructose 1,6-bis(dihydrogen phosphate), trisodium salt, octahydrate
    • trisodium fructose 1,6-diphosphate octahydrate
    • Fosfructose trisodium (USAN)
    • FOSFRUCTOSE TRISODIUM (MART.)
    • MONOHYDROGEN MONOSODIUM MONO((2R,3R,4R)-2,3,4-TRIHYDROXY-5-OXOHEXANE-1,6-DIYL BIS(PHOSPHATE)) HYDRATE
    • RefChem:141386
    • Fosfructose trisodium octahydrate
    • 102416-04-6
    • trisodium;hydron;[(2R,3R,4S)-2,3,4-trihydroxy-5-oxo-6-phosphonatooxyhexyl] phosphate;octahydrate
    • 81028-91-3

  • Applications

    Fosfructose Trisodium, CAS 81028-91-3, is commonly used as a buffering and metal-chelating salt in industrial formulations, including cleaning products, to control pH and sequester metal ions present in water; it can function as an intermediate or processing aid in chemical manufacturing; in the polymers/plastics sector it may serve as a stabilizer or processing aid during formulation and processing of plastics; in coatings and inks it can help stabilize color systems and manage metal ion activity during pigment dispersion; in electronics-related manufacturing and cleaning steps it may be employed as a complexing agent or pH-control additive for surface preparation. Use is subject to local regulations and formulation limits.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 5.79
    methanol 6.59
    isopropanol 3.92
    water 0.11
    ethyl acetate 1.79
    n-propanol 4.25
    acetone 3.29
    n-butanol 3.7
    acetonitrile 2.72
    DMF 6.74
    toluene 0.45
    isobutanol 3.08
    1,4-dioxane 3.6
    methyl acetate 2.08
    THF 4.06
    2-butanone 2.32
    n-pentanol 2.41
    sec-butanol 3.28
    n-hexane 0.56
    ethylene glycol 2.91
    NMP 5.18
    cyclohexane 0.33
    DMSO 6.12
    n-butyl acetate 2.24
    n-octanol 1.83
    chloroform 2.49
    n-propyl acetate 1.24
    acetic acid 5.48
    dichloromethane 2.01
    cyclohexanone 2.82
    propylene glycol 3.01
    isopropyl acetate 1.06
    DMAc 3.48
    2-ethoxyethanol 2.66
    isopentanol 2.89
    n-heptane 0.46
    ethyl formate 1.41
    1,2-dichloroethane 1.39
    n-hexanol 3.91
    2-methoxyethanol 5.06
    isobutyl acetate 0.87
    tetrachloromethane 0.55
    n-pentyl acetate 1.11
    transcutol 8.53
    n-heptanol 1.7
    ethylbenzene 0.42
    MIBK 1.32
    2-propoxyethanol 4.28
    tert-butanol 4.41
    MTBE 2.35
    2-butoxyethanol 2.36
    propionic acid 3.72
    o-xylene 0.48
    formic acid 2.61
    diethyl ether 2.07
    m-xylene 0.47
    p-xylene 0.55
    chlorobenzene 0.86
    dimethyl carbonate 0.83
    n-octane 0.19
    formamide 2.56
    cyclopentanone 3.68
    2-pentanone 1.91
    anisole 1.12
    cyclopentyl methyl ether 2.12
    gamma-butyrolactone 4.33
    1-methoxy-2-propanol 3.71
    pyridine 1.85
    3-pentanone 1.35
    furfural 3.06
    n-dodecane 0.17
    diethylene glycol 3.47
    diisopropyl ether 0.68
    tert-amyl alcohol 3.45
    acetylacetone 1.57
    n-hexadecane 0.18
    acetophenone 1.04
    methyl propionate 1.78
    isopentyl acetate 1.9
    trichloroethylene 2.43
    n-nonanol 1.47
    cyclohexanol 2.24
    benzyl alcohol 1.1
    2-ethylhexanol 2.0
    isooctanol 1.33
    dipropyl ether 1.67
    1,2-dichlorobenzene 0.87
    ethyl lactate 0.97
    propylene carbonate 2.23
    n-methylformamide 3.59
    2-pentanol 2.46
    n-pentane 0.46
    1-propoxy-2-propanol 3.17
    1-methoxy-2-propyl acetate 1.73
    2-(2-methoxypropoxy) propanol 2.17
    mesitylene 0.38
    ε-caprolactone 2.47
    p-cymene 0.49
    epichlorohydrin 3.03
    1,1,1-trichloroethane 1.34
    2-aminoethanol 4.28
    morpholine-4-carbaldehyde 4.01
    sulfolane 5.26
    2,2,4-trimethylpentane 0.3
    2-methyltetrahydrofuran 3.4
    n-hexyl acetate 1.94
    isooctane 0.24
    2-(2-butoxyethoxy)ethanol 3.06
    sec-butyl acetate 0.82
    tert-butyl acetate 1.4
    decalin 0.25
    glycerin 3.44
    diglyme 4.16
    acrylic acid 3.47
    isopropyl myristate 0.77
    n-butyric acid 3.55
    acetyl acetate 0.99
    di(2-ethylhexyl) phthalate 0.84
    ethyl propionate 1.07
    nitromethane 4.81
    1,2-diethoxyethane 2.1
    benzonitrile 1.3
    trioctyl phosphate 0.73
    1-bromopropane 1.09
    gamma-valerolactone 3.94
    n-decanol 1.13
    triethyl phosphate 0.64
    4-methyl-2-pentanol 1.49
    propionitrile 2.15
    vinylene carbonate 1.79
    1,1,2-trichlorotrifluoroethane 2.81
    DMS 1.2
    cumene 0.42
    2-octanol 1.14
    2-hexanone 1.46
    octyl acetate 1.08
    limonene 0.86
    1,2-dimethoxyethane 3.26
    ethyl orthosilicate 0.65
    tributyl phosphate 0.85
    diacetone alcohol 2.36
    N,N-dimethylaniline 0.92
    acrylonitrile 2.69
    aniline 1.19
    1,3-propanediol 4.14
    bromobenzene 0.7
    dibromomethane 1.44
    1,1,2,2-tetrachloroethane 2.22
    2-methyl-cyclohexyl acetate 1.11
    tetrabutyl urea 1.11
    diisobutyl methanol 1.08
    2-phenylethanol 1.5
    styrene 0.51
    dioctyl adipate 1.02
    dimethyl sulfate 1.34
    ethyl butyrate 1.29
    methyl lactate 1.53
    butyl lactate 1.18
    diethyl carbonate 0.82
    propanediol butyl ether 2.63
    triethyl orthoformate 0.92
    p-tert-butyltoluene 0.51
    methyl 4-tert-butylbenzoate 1.35
    morpholine 4.34
    tert-butylamine 2.92
    n-dodecanol 0.86
    dimethoxymethane 2.45
    ethylene carbonate 1.4
    cyrene 1.55
    2-ethoxyethyl acetate 1.4
    2-ethylhexyl acetate 1.42
    1,2,4-trichlorobenzene 1.05
    4-methylpyridine 1.82
    dibutyl ether 1.41
    2,6-dimethyl-4-heptanol 1.08
    DEF 2.54
    dimethyl isosorbide 2.61
    tetrachloroethylene 1.55
    eugenol 1.55
    triacetin 1.49
    span 80 2.1
    1,4-butanediol 1.82
    1,1-dichloroethane 1.54
    2-methyl-1-pentanol 2.11
    methyl formate 2.17
    2-methyl-1-butanol 2.82
    n-decane 0.26
    butyronitrile 2.14
    3,7-dimethyl-1-octanol 1.64
    1-chlorooctane 0.83
    1-chlorotetradecane 0.36
    n-nonane 0.27
    undecane 0.2
    tert-butylcyclohexane 0.31
    cyclooctane 0.14
    cyclopentanol 2.84
    tetrahydropyran 2.9
    tert-amyl methyl ether 1.78
    2,5,8-trioxanonane 3.05
    1-hexene 1.37
    2-isopropoxyethanol 1.95
    2,2,2-trifluoroethanol 1.56
    methyl butyrate 1.51

    Scent© AI

1 4

IFRA standard 51

Recommendation
No restriction
Maximum acceptable concentrations in the finished product (%)
Category 1
Products applied to the lips
 No restriction Category 7A
Rinse-off products applied to the hair with some hand contact
 No restriction
Category 2
Products applied to the axillae
 No restriction Category 7B
Leave-on products applied to the hair with some hand contact
 No restriction
Category 3
Products applied to the face/body using fingertips
 No restriction Category 8
Products with significant anogenital exposure
 No restriction
Category 4
Products related to fine fragrance
 No restriction Category 9
Products with body and hand exposure, primarily rinse off
 No restriction
Category 5A
Body lotion products applied to the body using the hands (palms), primarily leave on
 No restriction Category 10A
Household care products with mostly hand contact
 No restriction
Category 5B
Face moisturizer products applied to the face using the hands (palms), primarily leave on
 No restriction Category 10B
Household care products with mostly hand contact, including aerosol/spray products (with potential leave-on skin contact)
 No restriction
Category 5C
Hand cream products applied to the hands using the hands (palms), primarily leave on
 No restriction Category 11A
Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate without UV exposure
 No restriction
Category 5D
Baby Creams, baby Oils and baby talc
 No restriction Category 11B
Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate with potential UV exposure
 No restriction
Category 6
Products with oral and lip exposure
 No restriction Category 12
Products not intended for direct skin contact, minimal or insignificant transfer to skin
 No restriction