Calcium D-saccharate tetrahydrate

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  • Identifiers

    CAS number
    5793-89-5

    Molecular formula
    C6H16CaO12

    SMILES
    [C@H]([C@@H]([C@@H](C(=O)[O-])O)O)([C@H](C(=O)[O-])O)O.O.O.O.O.[Ca+2]

    Safety labels

    Irritant
    Irritant

  • Odor profile

    Fragrance
    Odorless 72.05%
    Sweet 42.4%
    Caramellic 28.32%
    Buttery 22.61%
    Savory 18.28%
    Milky 18.09%
    Clean 16.81%
    Burnt 15.69%
    Sharp 15.23%
    Creamy 15.12%

     

    Flavor
    Odorless 68.52%
    Very mild 34.27%
    Sweet-like 26.81%
    Bland 25.8%
    Mild 22.19%
    Caramellic 20.73%
    Yeast 20.17%
    Very slight 18.52%
    Acetoin 17.83%
    Cadaverous 17.71%

     

    Odor impact est.
    Low

  • Properties

    pKa est.
    -0.8 (strong acid)

    Molecular weight
    320.26 g/mol

    Flash point

    • 240.72 ˚C est.

  • Synonyms

    • 5793-89-5
    • Calcium D-saccharate tetrahydrate
    • D-Saccharic acid calcium salt tetrahydrate
    • Calcium saccharate tetrahydrate
    • Calcium (2R,3S,4S,5S)-2,3,4,5-tetrahydroxyhexanedioate tetrahydrate
    • C6H16CaO12
    • D-Glucaric acid (tetrahydrate)
    • 5793-89-5 (calcium hydrate)
    • Calcium D-glucarate (1:1), tetrahydrate
    • calcium;(2S,3S,4S,5R)-2,3,4,5-tetrahydroxyhexanedioate;tetrahydrate
    • Calcium saccharat-4-wasser
    • UNII-6AP9J91K4V
    • D-GLUCARIC ACID CALCIUM SALT TETRAHYDRATE
    • Calcium saccharate [USAN:USP:INN]
    • GLUCARIC
    • Calcium saccharate (USP)
    • Calcium D-Glucarate (hydrate)
    • orb1299427
    • SCHEMBL2414356
    • CalciumD-glucarate(tetrahydrate)
    • CALCIUM SACCHARATE [USP-RS]
    • AKOS027382576
    • Calcium D-glucarate--water (1/1/4)
    • Glucaric acid calcium salt Tetrahydrate
    • HY-128749A
    • AS-83024
    • CALCIUM D-SACCHARATE, TETRAHYDRATE
    • CALCIUM SACCHARATE [USP MONOGRAPH]
    • CS-0142009
    • D03307
    • F88034
    • Glucaric acid calcium salt (Calcium saccharate)
    • CALCIUM SACCHARATE TETRAHYDRATE [WHO-DD]
    • D-Glucaric acid, calcium salt (1:1) tetrahydrate
    • F492416
    • Q27264421
    • D-GLUCARIC ACID, CALCIUM SALT (1:1 TETRAHYDRATE
    • 5793-89-5

  • Applications

    Calcium D-saccharate tetrahydrate (CAS 5793-89-5) serves as a calcium source in multiple formulations, including animal feeds and pet foods; it may be used as a calcium fortificant in human foods and dietary supplements, subject to regulatory approvals; in food processing it is evaluated as a mineral fortifying agent; in agriculture it can supply calcium for crop nutrition via soil or foliar applications; in pharmaceutical formulations it can function as a calcium salt excipient or filler under appropriate regulatory constraints.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 43.6
    methanol 132.92
    isopropanol 16.39
    water 675.51
    ethyl acetate 2.25
    n-propanol 16.84
    acetone 11.52
    n-butanol 8.97
    acetonitrile 2.5
    DMF 290.94
    toluene 1.1
    isobutanol 6.02
    1,4-dioxane 18.1
    methyl acetate 3.12
    THF 13.72
    2-butanone 5.14
    n-pentanol 3.12
    sec-butanol 9.01
    n-hexane 0.55
    ethylene glycol 246.26
    NMP 157.52
    cyclohexane 2.8
    DMSO 1135.69
    n-butyl acetate 1.24
    n-octanol 3.02
    chloroform 0.56
    n-propyl acetate 0.8
    acetic acid 15.82
    dichloromethane 1.45
    cyclohexanone 7.18
    propylene glycol 79.69
    isopropyl acetate 1.31
    DMAc 167.23
    2-ethoxyethanol 35.75
    isopentanol 4.48
    n-heptane 1.96
    ethyl formate 3.75
    1,2-dichloroethane 2.75
    n-hexanol 4.28
    2-methoxyethanol 139.4
    isobutyl acetate 0.19
    tetrachloromethane 0.58
    n-pentyl acetate 1.12
    transcutol 22.03
    n-heptanol 3.56
    ethylbenzene 0.56
    MIBK 1.89
    2-propoxyethanol 18.98
    tert-butanol 14.74
    MTBE 2.96
    2-butoxyethanol 10.34
    propionic acid 10.59
    o-xylene 2.17
    formic acid 202.56
    diethyl ether 4.43
    m-xylene 1.15
    p-xylene 0.52
    chlorobenzene 0.24
    dimethyl carbonate 7.65
    n-octane 0.84
    formamide 237.89
    cyclopentanone 8.97
    2-pentanone 4.39
    anisole 1.12
    cyclopentyl methyl ether 6.26
    gamma-butyrolactone 12.01
    1-methoxy-2-propanol 55.43
    pyridine 4.44
    3-pentanone 4.29
    furfural 11.62
    n-dodecane 0.39
    diethylene glycol 54.26
    diisopropyl ether 1.25
    tert-amyl alcohol 9.87
    acetylacetone 5.3
    n-hexadecane 0.41
    acetophenone 1.74
    methyl propionate 6.3
    isopentyl acetate 0.67
    trichloroethylene 1.48
    n-nonanol 2.82
    cyclohexanol 9.06
    benzyl alcohol 2.59
    2-ethylhexanol 1.78
    isooctanol 1.93
    dipropyl ether 3.48
    1,2-dichlorobenzene 0.34
    ethyl lactate 3.72
    propylene carbonate 2.74
    n-methylformamide 98.64
    2-pentanol 5.08
    n-pentane 1.36
    1-propoxy-2-propanol 10.72
    1-methoxy-2-propyl acetate 3.63
    2-(2-methoxypropoxy) propanol 8.15
    mesitylene 1.17
    ε-caprolactone 5.67
    p-cymene 0.98
    epichlorohydrin 7.05
    1,1,1-trichloroethane 0.43
    2-aminoethanol 131.5
    morpholine-4-carbaldehyde 85.25
    sulfolane 69.92
    2,2,4-trimethylpentane 0.4
    2-methyltetrahydrofuran 5.61
    n-hexyl acetate 1.39
    isooctane 0.21
    2-(2-butoxyethoxy)ethanol 13.19
    sec-butyl acetate 0.43
    tert-butyl acetate 1.66
    decalin 0.4
    glycerin 176.84
    diglyme 20.19
    acrylic acid 15.73
    isopropyl myristate 0.72
    n-butyric acid 4.96
    acetyl acetate 1.01
    di(2-ethylhexyl) phthalate 0.86
    ethyl propionate 1.28
    nitromethane 23.46
    1,2-diethoxyethane 3.24
    benzonitrile 0.65
    trioctyl phosphate 1.19
    1-bromopropane 1.15
    gamma-valerolactone 22.98
    n-decanol 2.33
    triethyl phosphate 1.47
    4-methyl-2-pentanol 1.87
    propionitrile 1.91
    vinylene carbonate 2.68
    1,1,2-trichlorotrifluoroethane 22.09
    DMS 1.98
    cumene 0.44
    2-octanol 1.96
    2-hexanone 1.14
    octyl acetate 1.16
    limonene 1.81
    1,2-dimethoxyethane 20.56
    ethyl orthosilicate 1.31
    tributyl phosphate 0.82
    diacetone alcohol 9.17
    N,N-dimethylaniline 2.38
    acrylonitrile 3.39
    aniline 3.09
    1,3-propanediol 75.56
    bromobenzene 0.2
    dibromomethane 1.08
    1,1,2,2-tetrachloroethane 2.48
    2-methyl-cyclohexyl acetate 0.84
    tetrabutyl urea 2.71
    diisobutyl methanol 1.37
    2-phenylethanol 2.35
    styrene 0.46
    dioctyl adipate 1.07
    dimethyl sulfate 26.85
    ethyl butyrate 1.29
    methyl lactate 21.87
    butyl lactate 2.69
    diethyl carbonate 0.78
    propanediol butyl ether 12.21
    triethyl orthoformate 1.48
    p-tert-butyltoluene 1.1
    methyl 4-tert-butylbenzoate 3.42
    morpholine 29.81
    tert-butylamine 6.2
    n-dodecanol 1.84
    dimethoxymethane 51.96
    ethylene carbonate 2.24
    cyrene 12.8
    2-ethoxyethyl acetate 2.0
    2-ethylhexyl acetate 0.59
    1,2,4-trichlorobenzene 0.5
    4-methylpyridine 2.89
    dibutyl ether 1.29
    2,6-dimethyl-4-heptanol 1.37
    DEF 22.99
    dimethyl isosorbide 8.51
    tetrachloroethylene 2.9
    eugenol 3.72
    triacetin 1.94
    span 80 7.17
    1,4-butanediol 24.35
    1,1-dichloroethane 0.65
    2-methyl-1-pentanol 1.74
    methyl formate 39.33
    2-methyl-1-butanol 4.73
    n-decane 0.66
    butyronitrile 1.36
    3,7-dimethyl-1-octanol 1.38
    1-chlorooctane 0.87
    1-chlorotetradecane 0.44
    n-nonane 0.73
    undecane 0.5
    tert-butylcyclohexane 0.2
    cyclooctane 1.58
    cyclopentanol 9.83
    tetrahydropyran 5.71
    tert-amyl methyl ether 3.83
    2,5,8-trioxanonane 18.26
    1-hexene 0.59
    2-isopropoxyethanol 10.06
    2,2,2-trifluoroethanol 20.48
    methyl butyrate 1.62

    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