Sonderianin

Overview IFRA Request a quote

  • Identifiers

    CAS number
    79405-82-6

    Molecular formula
    C21H26O5

    SMILES
    CC1CCC2(C(C13CC(OC3=O)C4=COC=C4)CCC=C2C(=O)OC)C

    Safety labels

  • Odor profile

    Fragrance
    Woody 45.56%
    Herbal 42.08%
    Green 36.56%
    Mint 32.19%
    Fruity 29.85%
    Floral 27.31%
    Spicy 27.04%
    Tobacco 26.94%
    Sweet 26.57%
    Fresh 25.99%

     

    Flavor
    Bitter 80.56%
    Cedarleaf 22.17%
    Herbal 22.17%
    Lovage 21.61%
    Ripe apricot 21.6%
    Parsley 20.99%
    Red fruit 20.97%
    Ethyl benzoate 19.84%
    Leaves 19.69%
    Heather 19.64%

     

    Odor impact est.
    Medium

  • Properties

    XLogP3-AA
    4.1

    pKa est.
    5.6 (weak acid)

    Molecular weight
    358.4 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Slow

    Boiling point est.
    443°C

    Flash point

    • 186.61 ˚C est.

  • Synonyms

    • Sonderianin
    • 79405-82-6
    • methyl 5'-(furan-3-yl)-6,8a-dimethyl-2'-oxospiro[3,4,4a,6,7,8-hexahydronaphthalene-5,3'-oxolane]-1-carboxylate
    • NSC606843
    • NSC 606843
    • methyl 5'-(3-furyl)-6,8a-dimethyl-2'-oxo-spiro[3,4,4a,6,7,8-hexahydronaphthalene-5,3'-tetrahydrofuran]-1-carboxylate
    • Spiro(furan-3(2H),1'(2'H)-naphthalene)-5'-carboxylic acid, 5-(3-furanyl)-3',4,4',4'a,5,7',8',8'a-octahydro-2',4'a-dimethyl-2-oxo-, methyl ester, (1'alpha(S*),2'alpha,4'aalpha,8'abeta)-(-)-
    • Spiro[furan-3(2H),1'(2'H)-naphthalene]-5'-carboxylic acid, 5-(3-furanyl)-3',4,4',4'a,5,7',8',8'a-octahydro-2',4'a-dimethyl-2-oxo-, methyl ester
    • 79405-82-6

  • Applications

    Sonderianin (CAS 79405-82-6) is a chemical considered for several industrial applications based on its fragrance-related properties and synthetic versatility. In perfumery and cosmetics, it may function as an odorant or fragrance component and can serve as a fragrance fixative in personal care formulations. In industrial manufacturing, it is evaluated as a chemical intermediate or solvent/processing aid used to prepare derivatives and additives for coatings, inks, and adhesives. It may also be considered for use as a processing or formulation component in other industrial systems, subject to local regulations and formulation limits.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 8.8
    methanol 13.26
    isopropanol 10.94
    water 0.02
    ethyl acetate 22.57
    n-propanol 12.82
    acetone 38.44
    n-butanol 14.71
    acetonitrile 20.33
    DMF 75.66
    toluene 42.09
    isobutanol 11.04
    1,4-dioxane 50.96
    methyl acetate 23.06
    THF 78.47
    2-butanone 39.52
    n-pentanol 9.58
    sec-butanol 8.94
    n-hexane 0.26
    ethylene glycol 2.81
    NMP 67.91
    cyclohexane 1.46
    DMSO 48.56
    n-butyl acetate 17.94
    n-octanol 4.35
    chloroform 148.15
    n-propyl acetate 15.31
    acetic acid 21.47
    dichloromethane 92.68
    cyclohexanone 76.77
    propylene glycol 3.62
    isopropyl acetate 20.08
    DMAc 79.41
    2-ethoxyethanol 22.96
    isopentanol 16.15
    n-heptane 0.23
    ethyl formate 14.16
    1,2-dichloroethane 54.67
    n-hexanol 12.34
    2-methoxyethanol 38.62
    isobutyl acetate 13.47
    tetrachloromethane 11.89
    n-pentyl acetate 16.87
    transcutol 38.07
    n-heptanol 8.47
    ethylbenzene 9.9
    MIBK 25.78
    2-propoxyethanol 40.95
    tert-butanol 13.06
    MTBE 8.76
    2-butoxyethanol 26.71
    propionic acid 13.88
    o-xylene 17.52
    formic acid 10.51
    diethyl ether 12.88
    m-xylene 20.61
    p-xylene 13.61
    chlorobenzene 46.4
    dimethyl carbonate 23.97
    n-octane 0.15
    formamide 19.57
    cyclopentanone 79.81
    2-pentanone 33.71
    anisole 22.78
    cyclopentyl methyl ether 24.64
    gamma-butyrolactone 63.72
    1-methoxy-2-propanol 37.7
    pyridine 69.93
    3-pentanone 31.22
    furfural 67.46
    n-dodecane 0.19
    diethylene glycol 31.01
    diisopropyl ether 3.95
    tert-amyl alcohol 10.01
    acetylacetone 46.42
    n-hexadecane 0.25
    acetophenone 30.08
    methyl propionate 25.94
    isopentyl acetate 21.32
    trichloroethylene 139.89
    n-nonanol 5.49
    cyclohexanol 18.74
    benzyl alcohol 26.69
    2-ethylhexanol 7.65
    isooctanol 7.93
    dipropyl ether 5.6
    1,2-dichlorobenzene 42.56
    ethyl lactate 13.46
    propylene carbonate 32.74
    n-methylformamide 27.93
    2-pentanol 8.09
    n-pentane 0.41
    1-propoxy-2-propanol 24.63
    1-methoxy-2-propyl acetate 32.51
    2-(2-methoxypropoxy) propanol 26.1
    mesitylene 10.56
    ε-caprolactone 44.44
    p-cymene 7.12
    epichlorohydrin 85.13
    1,1,1-trichloroethane 46.5
    2-aminoethanol 6.61
    morpholine-4-carbaldehyde 70.28
    sulfolane 81.15
    2,2,4-trimethylpentane 0.5
    2-methyltetrahydrofuran 29.25
    n-hexyl acetate 16.48
    isooctane 0.39
    2-(2-butoxyethoxy)ethanol 27.27
    sec-butyl acetate 12.24
    tert-butyl acetate 21.85
    decalin 0.89
    glycerin 11.88
    diglyme 50.38
    acrylic acid 16.76
    isopropyl myristate 7.92
    n-butyric acid 25.68
    acetyl acetate 22.56
    di(2-ethylhexyl) phthalate 16.32
    ethyl propionate 16.17
    nitromethane 48.04
    1,2-diethoxyethane 13.75
    benzonitrile 35.96
    trioctyl phosphate 9.4
    1-bromopropane 20.49
    gamma-valerolactone 99.0
    n-decanol 3.89
    triethyl phosphate 11.32
    4-methyl-2-pentanol 7.97
    propionitrile 26.41
    vinylene carbonate 39.83
    1,1,2-trichlorotrifluoroethane 66.71
    DMS 24.08
    cumene 6.76
    2-octanol 4.43
    2-hexanone 19.51
    octyl acetate 10.11
    limonene 7.47
    1,2-dimethoxyethane 38.0
    ethyl orthosilicate 10.49
    tributyl phosphate 9.62
    diacetone alcohol 29.79
    N,N-dimethylaniline 15.32
    acrylonitrile 38.62
    aniline 40.07
    1,3-propanediol 17.26
    bromobenzene 47.37
    dibromomethane 53.8
    1,1,2,2-tetrachloroethane 93.07
    2-methyl-cyclohexyl acetate 18.71
    tetrabutyl urea 15.56
    diisobutyl methanol 5.71
    2-phenylethanol 30.92
    styrene 12.69
    dioctyl adipate 14.81
    dimethyl sulfate 38.55
    ethyl butyrate 13.99
    methyl lactate 21.27
    butyl lactate 17.32
    diethyl carbonate 11.02
    propanediol butyl ether 14.75
    triethyl orthoformate 12.44
    p-tert-butyltoluene 6.39
    methyl 4-tert-butylbenzoate 30.75
    morpholine 51.28
    tert-butylamine 5.74
    n-dodecanol 2.75
    dimethoxymethane 54.15
    ethylene carbonate 32.74
    cyrene 38.66
    2-ethoxyethyl acetate 27.72
    2-ethylhexyl acetate 15.9
    1,2,4-trichlorobenzene 52.04
    4-methylpyridine 64.1
    dibutyl ether 4.2
    2,6-dimethyl-4-heptanol 5.71
    DEF 31.38
    dimethyl isosorbide 46.71
    tetrachloroethylene 60.51
    eugenol 32.68
    triacetin 24.77
    span 80 19.65
    1,4-butanediol 6.57
    1,1-dichloroethane 43.9
    2-methyl-1-pentanol 11.01
    methyl formate 21.46
    2-methyl-1-butanol 12.86
    n-decane 0.34
    butyronitrile 21.98
    3,7-dimethyl-1-octanol 6.32
    1-chlorooctane 2.86
    1-chlorotetradecane 1.28
    n-nonane 0.23
    undecane 0.25
    tert-butylcyclohexane 0.63
    cyclooctane 0.45
    cyclopentanol 16.58
    tetrahydropyran 34.23
    tert-amyl methyl ether 7.99
    2,5,8-trioxanonane 38.07
    1-hexene 2.04
    2-isopropoxyethanol 17.99
    2,2,2-trifluoroethanol 15.1
    methyl butyrate 19.39

    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