Saccharin Calcium

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  • Identifiers

    CAS number
    6485-34-3

    Molecular formula
    C14H8CaN2O6S2

    SMILES
    C1=CC=C2C(=C1)C(=NS2(=O)=O)[O-].C1=CC=C2C(=C1)C(=NS2(=O)=O)[O-].[Ca+2]

    Safety labels

    Irritant
    Irritant

  • Odor profile

    Fragrance
    Odorless 85.46%
    Burnt 18.86%
    Bitter 18.79%
    Cooked 16.26%
    Savory 13.9%
    Pungent 13.52%
    Roasted 12.97%
    Nutty 12.95%
    Aromatic 11.3%
    Popcorn 11.28%

     

    Flavor
    Bitter 83.39%
    Odorless 25.5%
    Nitrile 21.47%
    Taco 19.96%
    Very strong 19.62%
    Bread crust 19.39%
    Indole 19.27%
    Roasted peanuts 18.99%
    Lovage 18.74%
    Moth ball 18.66%

     

    Odor impact est.
    High

  • Properties

    pKa est.
    5.68 (weak acid)

    Molecular weight
    404.4 g/mol

    Flash point

    • 171.87 ˚C est.

  • Synonyms

    • Calcium saccharin
    • Saccharin calcium
    • 6485-34-3
    • Calcium saccharina
    • Calcium saccharinate
    • Calcium o-benzosulfimide
    • Calcium o-benzosulphimide
    • Calcium 2-benzosulphimide
    • Saccharin, calcium
    • SACCHARIN CALCIUM ANHYDROUS
    • CCRIS 4226
    • Sulphobenzoic imide calcium salt
    • EINECS 229-349-9
    • 09AW1ODN7B
    • Calcium saccharin, anhydrous
    • 1,2-Benzisothiazolin-3-one, 1,1-dioxide, calcium salt
    • Calcium saccharin hydrate
    • 1,2-Benzisothiazol-3(2H)-one, 1,1-dioxide, calcium salt
    • DTXSID0021252
    • CALCIUM SACCHARIN ANHYDROUS
    • 1,2-Benzisothiazol-3(2H)-one, 1,1-dioxide, calcium salt (2:1)
    • SACCHARIN CALCIUM [WHO-DD]
    • 1,1-Dioxide-1,2-benzisothiazol-3(2H)-one, calcium salt
    • Calcium, Saccharin
    • calcium;1,1-dioxo-1,2-benzothiazol-3-olate;1-oxido-1-oxo-1,2-benzothiazol-3-one
    • Calcium saccharin hydrous
    • Hydrated saccharin calcium
    • 6381-91-5
    • SACCHARIN CALCIUM (II)
    • SACCHARIN CALCIUM [II]
    • INS NO.954(II)
    • CALCIUM SACCHARIN [FCC]
    • INS-954(II)
    • SACCHARIN CALCIUM [VANDF]
    • SACCHARIN CALCIUM (MART.)
    • SACCHARIN CALCIUM [MART.]
    • SACCHARIN CALCIUM (USP-RS)
    • SACCHARIN CALCIUM [USP-RS]
    • E-954(II)
    • CALCIUM O-BENZOLSULFIMIDE HYDRATE
    • SACCHARIN CALCIUM (USP MONOGRAPH)
    • SACCHARIN CALCIUM [USP MONOGRAPH]
    • UNII-09AW1ODN7B
    • Calcium Saccharin USP-23
    • SCHEMBL49027
    • DTXCID801252
    • SCHEMBL1532580
    • CALCIUM SACCHARIN [INCI]
    • CHEMBL2219732
    • FLJJRNVAIQYWBP-UHFFFAOYSA-L
    • calcium bis(3-oxo-3H-1,2-benzisothiazol-2-ide 1,1-dioxide)
    • calcium;1,1-dioxo-1,2-benzothiazol-3-olate
    • Q27236475

  • Applications

    Saccharin Calcium, also known as calcium saccharinate (CAS number: 6485-34-3), is primarily used as a non-nutritive sweetener in food and beverage formulations to reduce added sugar and calories. It is also employed in pharmaceutical and nutraceutical formulations as a sweetening and flavor-masking aid for tablets and syrups. In cosmetics and personal care, products such as toothpaste and mouthwash may use Saccharin Calcium to impart sweetness and mask undesirable tastes. It is applicable in sugar-free confectionery and chewing gum to provide a pleasant sweet taste without added sugar. Its use is subject to local regulations and formulation limits.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 35.1
    methanol 58.22
    isopropanol 23.03
    water 0.8
    ethyl acetate 39.52
    n-propanol 21.32
    acetone 102.21
    n-butanol 23.5
    acetonitrile 67.87
    DMF 495.34
    toluene 6.27
    isobutanol 12.39
    1,4-dioxane 68.98
    methyl acetate 55.83
    THF 130.98
    2-butanone 64.91
    n-pentanol 16.74
    sec-butanol 20.48
    n-hexane 0.52
    ethylene glycol 40.6
    NMP 219.68
    cyclohexane 0.92
    DMSO 334.87
    n-butyl acetate 30.66
    n-octanol 36.59
    chloroform 27.81
    n-propyl acetate 24.56
    acetic acid 22.85
    dichloromethane 28.98
    cyclohexanone 69.9
    propylene glycol 27.2
    isopropyl acetate 28.37
    DMAc 235.67
    2-ethoxyethanol 78.5
    isopentanol 18.32
    n-heptane 1.18
    ethyl formate 50.93
    1,2-dichloroethane 39.13
    n-hexanol 23.06
    2-methoxyethanol 236.13
    isobutyl acetate 10.99
    tetrachloromethane 3.75
    n-pentyl acetate 32.83
    transcutol 410.5
    n-heptanol 19.5
    ethylbenzene 5.46
    MIBK 34.61
    2-propoxyethanol 99.43
    tert-butanol 26.04
    MTBE 13.55
    2-butoxyethanol 60.48
    propionic acid 21.39
    o-xylene 6.74
    formic acid 38.13
    diethyl ether 22.79
    m-xylene 6.84
    p-xylene 6.43
    chlorobenzene 16.6
    dimethyl carbonate 50.02
    n-octane 1.1
    formamide 124.56
    cyclopentanone 108.51
    2-pentanone 59.76
    anisole 29.45
    cyclopentyl methyl ether 32.49
    gamma-butyrolactone 109.75
    1-methoxy-2-propanol 146.3
    pyridine 46.51
    3-pentanone 38.75
    furfural 140.3
    n-dodecane 1.96
    diethylene glycol 134.35
    diisopropyl ether 6.55
    tert-amyl alcohol 21.1
    acetylacetone 97.42
    n-hexadecane 2.31
    acetophenone 41.17
    methyl propionate 52.41
    isopentyl acetate 23.28
    trichloroethylene 60.68
    n-nonanol 33.39
    cyclohexanol 19.03
    benzyl alcohol 27.82
    2-ethylhexanol 13.7
    isooctanol 13.4
    dipropyl ether 14.55
    1,2-dichlorobenzene 24.28
    ethyl lactate 38.25
    propylene carbonate 48.98
    n-methylformamide 179.02
    2-pentanol 17.76
    n-pentane 0.68
    1-propoxy-2-propanol 61.9
    1-methoxy-2-propyl acetate 56.19
    2-(2-methoxypropoxy) propanol 87.44
    mesitylene 5.62
    ε-caprolactone 55.19
    p-cymene 7.72
    epichlorohydrin 122.27
    1,1,1-trichloroethane 17.79
    2-aminoethanol 39.24
    morpholine-4-carbaldehyde 235.04
    sulfolane 156.7
    2,2,4-trimethylpentane 0.46
    2-methyltetrahydrofuran 42.61
    n-hexyl acetate 56.14
    isooctane 0.46
    2-(2-butoxyethoxy)ethanol 138.31
    sec-butyl acetate 15.22
    tert-butyl acetate 31.08
    decalin 0.97
    glycerin 76.77
    diglyme 187.33
    acrylic acid 26.35
    isopropyl myristate 26.56
    n-butyric acid 29.48
    acetyl acetate 30.66
    di(2-ethylhexyl) phthalate 24.04
    ethyl propionate 27.49
    nitromethane 170.15
    1,2-diethoxyethane 63.54
    benzonitrile 44.02
    trioctyl phosphate 21.6
    1-bromopropane 11.91
    gamma-valerolactone 156.53
    n-decanol 25.68
    triethyl phosphate 17.11
    4-methyl-2-pentanol 11.08
    propionitrile 39.22
    vinylene carbonate 48.73
    1,1,2-trichlorotrifluoroethane 102.65
    DMS 51.18
    cumene 4.81
    2-octanol 20.08
    2-hexanone 34.09
    octyl acetate 35.21
    limonene 9.28
    1,2-dimethoxyethane 131.15
    ethyl orthosilicate 13.52
    tributyl phosphate 25.22
    diacetone alcohol 70.15
    N,N-dimethylaniline 23.77
    acrylonitrile 79.2
    aniline 19.05
    1,3-propanediol 65.4
    bromobenzene 13.52
    dibromomethane 16.94
    1,1,2,2-tetrachloroethane 57.26
    2-methyl-cyclohexyl acetate 19.77
    tetrabutyl urea 45.94
    diisobutyl methanol 10.66
    2-phenylethanol 37.63
    styrene 6.79
    dioctyl adipate 33.0
    dimethyl sulfate 93.9
    ethyl butyrate 24.44
    methyl lactate 86.37
    butyl lactate 45.66
    diethyl carbonate 17.85
    propanediol butyl ether 97.78
    triethyl orthoformate 18.4
    p-tert-butyltoluene 7.38
    methyl 4-tert-butylbenzoate 44.33
    morpholine 90.11
    tert-butylamine 10.19
    n-dodecanol 19.81
    dimethoxymethane 178.25
    ethylene carbonate 37.54
    cyrene 60.82
    2-ethoxyethyl acetate 54.49
    2-ethylhexyl acetate 17.63
    1,2,4-trichlorobenzene 27.74
    4-methylpyridine 46.84
    dibutyl ether 25.5
    2,6-dimethyl-4-heptanol 10.66
    DEF 103.83
    dimethyl isosorbide 111.17
    tetrachloroethylene 32.47
    eugenol 71.96
    triacetin 55.15
    span 80 57.9
    1,4-butanediol 25.13
    1,1-dichloroethane 20.21
    2-methyl-1-pentanol 12.72
    methyl formate 130.11
    2-methyl-1-butanol 15.09
    n-decane 2.67
    butyronitrile 40.31
    3,7-dimethyl-1-octanol 24.56
    1-chlorooctane 13.85
    1-chlorotetradecane 7.22
    n-nonane 2.17
    undecane 2.29
    tert-butylcyclohexane 0.73
    cyclooctane 0.56
    cyclopentanol 27.22
    tetrahydropyran 29.28
    tert-amyl methyl ether 15.52
    2,5,8-trioxanonane 149.95
    1-hexene 2.88
    2-isopropoxyethanol 41.63
    2,2,2-trifluoroethanol 24.29
    methyl butyrate 37.46

    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