Apodoa

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  • Identifiers

    CAS number
    92751-87-6

    Molecular formula
    C15H24O7

    SMILES
    C/C(=C\CC[C@@](C)(C=C)O[C@H]1[C@@H]([C@H]([C@H](CO1)O)O)O)/C(=O)O

    Safety labels

  • Odor profile

    Fragrance
    Odorless 47.49%
    Sweet 34.83%
    Woody 24.35%
    Milky 23.59%
    Fresh 22.71%
    Spicy 21.66%
    Lactonic 20.05%
    Floral 19.87%
    Citrus 19.75%
    Dry 19.71%

     

    Flavor
    Bitter 62.29%
    Odorless 27.61%
    Bland 20.6%
    Sweet-like 20.44%
    Cedarleaf 20.4%
    Broom 19.5%
    Heather 19.48%
    Leaves 19.29%
    Parsley 19.12%
    Genet 19.01%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    -0.1

    pKa est.
    5.96 (weak acid)

    Molecular weight
    316.35 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    781°C

    Flash point

    • 218.09 ˚C est.

  • Synonyms

    • Apodoa
    • 92751-87-6
    • (2E,6S)-2,6-dimethyl-6-[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxyocta-2,7-dienoic acid
    • Compound NP-009335
    • 6 alpha-arabinosyloxy-2,6-dimethyl-2,7-octadienoic acid
    • 6alpha-Arabinosyloxy-2,6-dimethyl-2,7-octadienoic acid
    • AKOS040739230
    • NCGC00385332-01
    • 2,7-Octadienoic acid, 6-(alpha-L-arabinopyranosyloxy)-2,6-dimethyl-, (S-(E))-
    • 92751-87-6

  • Applications

    Apodoa (CAS 92751-87-6) may function as a solvent and processing intermediate in industrial manufacturing, and in polymers/plastics it may act as a plasticizer or stabilizer; it may be used as a solvent or diluent in coatings and inks and in adhesives; in fragrance applications it may serve as a fragrance ingredient or fixative; and in household cleaning products it may be used as a solvent or co-solvent to enhance solubility.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 116.77
    methanol 344.0
    isopropanol 41.71
    water 11.4
    ethyl acetate 13.86
    n-propanol 60.57
    acetone 47.93
    n-butanol 53.41
    acetonitrile 7.08
    DMF 236.72
    toluene 4.43
    isobutanol 23.91
    1,4-dioxane 73.75
    methyl acetate 11.36
    THF 141.48
    2-butanone 20.24
    n-pentanol 20.22
    sec-butanol 33.16
    n-hexane 0.53
    ethylene glycol 98.28
    NMP 112.86
    cyclohexane 2.41
    DMSO 694.61
    n-butyl acetate 2.64
    n-octanol 8.53
    chloroform 5.08
    n-propyl acetate 3.75
    acetic acid 168.73
    dichloromethane 5.03
    cyclohexanone 38.81
    propylene glycol 96.06
    isopropyl acetate 8.66
    DMAc 237.32
    2-ethoxyethanol 140.21
    isopentanol 31.21
    n-heptane 0.75
    ethyl formate 15.79
    1,2-dichloroethane 6.55
    n-hexanol 12.27
    2-methoxyethanol 376.94
    isobutyl acetate 2.14
    tetrachloromethane 1.53
    n-pentyl acetate 4.68
    transcutol 138.29
    n-heptanol 10.62
    ethylbenzene 2.26
    MIBK 15.61
    2-propoxyethanol 57.36
    tert-butanol 51.15
    MTBE 11.3
    2-butoxyethanol 33.63
    propionic acid 36.57
    o-xylene 5.01
    formic acid 332.15
    diethyl ether 12.79
    m-xylene 4.24
    p-xylene 2.37
    chlorobenzene 1.96
    dimethyl carbonate 16.29
    n-octane 0.58
    formamide 334.82
    cyclopentanone 54.4
    2-pentanone 25.65
    anisole 7.5
    cyclopentyl methyl ether 26.3
    gamma-butyrolactone 53.57
    1-methoxy-2-propanol 172.98
    pyridine 17.82
    3-pentanone 12.88
    furfural 44.64
    n-dodecane 0.35
    diethylene glycol 103.2
    diisopropyl ether 3.05
    tert-amyl alcohol 40.8
    acetylacetone 38.75
    n-hexadecane 0.39
    acetophenone 10.84
    methyl propionate 17.64
    isopentyl acetate 4.13
    trichloroethylene 11.56
    n-nonanol 8.7
    cyclohexanol 35.98
    benzyl alcohol 17.99
    2-ethylhexanol 5.13
    isooctanol 8.33
    dipropyl ether 4.03
    1,2-dichlorobenzene 2.49
    ethyl lactate 12.21
    propylene carbonate 17.61
    n-methylformamide 111.23
    2-pentanol 24.12
    n-pentane 1.04
    1-propoxy-2-propanol 25.28
    1-methoxy-2-propyl acetate 13.43
    2-(2-methoxypropoxy) propanol 34.02
    mesitylene 3.01
    ε-caprolactone 30.28
    p-cymene 1.91
    epichlorohydrin 45.87
    1,1,1-trichloroethane 3.1
    2-aminoethanol 161.66
    morpholine-4-carbaldehyde 127.79
    sulfolane 127.15
    2,2,4-trimethylpentane 0.7
    2-methyltetrahydrofuran 37.43
    n-hexyl acetate 7.47
    isooctane 0.44
    2-(2-butoxyethoxy)ethanol 54.15
    sec-butyl acetate 3.18
    tert-butyl acetate 13.0
    decalin 0.69
    glycerin 173.45
    diglyme 81.13
    acrylic acid 43.43
    isopropyl myristate 3.1
    n-butyric acid 42.57
    acetyl acetate 9.68
    di(2-ethylhexyl) phthalate 6.55
    ethyl propionate 4.82
    nitromethane 112.11
    1,2-diethoxyethane 12.51
    benzonitrile 4.85
    trioctyl phosphate 4.91
    1-bromopropane 2.59
    gamma-valerolactone 103.79
    n-decanol 6.35
    triethyl phosphate 4.15
    4-methyl-2-pentanol 11.87
    propionitrile 4.87
    vinylene carbonate 14.2
    1,1,2-trichlorotrifluoroethane 74.5
    DMS 7.64
    cumene 1.72
    2-octanol 5.6
    2-hexanone 6.45
    octyl acetate 4.81
    limonene 3.37
    1,2-dimethoxyethane 85.25
    ethyl orthosilicate 4.2
    tributyl phosphate 4.38
    diacetone alcohol 52.89
    N,N-dimethylaniline 8.2
    acrylonitrile 8.29
    aniline 13.33
    1,3-propanediol 204.02
    bromobenzene 1.42
    dibromomethane 3.0
    1,1,2,2-tetrachloroethane 12.45
    2-methyl-cyclohexyl acetate 5.35
    tetrabutyl urea 8.49
    diisobutyl methanol 4.21
    2-phenylethanol 10.66
    styrene 2.16
    dioctyl adipate 6.66
    dimethyl sulfate 37.04
    ethyl butyrate 3.05
    methyl lactate 40.15
    butyl lactate 10.48
    diethyl carbonate 2.42
    propanediol butyl ether 43.05
    triethyl orthoformate 4.14
    p-tert-butyltoluene 2.16
    methyl 4-tert-butylbenzoate 17.59
    morpholine 114.94
    tert-butylamine 13.28
    n-dodecanol 4.47
    dimethoxymethane 117.96
    ethylene carbonate 11.77
    cyrene 45.19
    2-ethoxyethyl acetate 10.81
    2-ethylhexyl acetate 2.56
    1,2,4-trichlorobenzene 4.23
    4-methylpyridine 12.18
    dibutyl ether 3.74
    2,6-dimethyl-4-heptanol 4.21
    DEF 47.64
    dimethyl isosorbide 41.66
    tetrachloroethylene 10.63
    eugenol 19.41
    triacetin 13.53
    span 80 27.47
    1,4-butanediol 61.1
    1,1-dichloroethane 2.87
    2-methyl-1-pentanol 17.12
    methyl formate 69.02
    2-methyl-1-butanol 27.43
    n-decane 0.67
    butyronitrile 6.3
    3,7-dimethyl-1-octanol 7.43
    1-chlorooctane 1.99
    1-chlorotetradecane 0.89
    n-nonane 0.61
    undecane 0.47
    tert-butylcyclohexane 0.47
    cyclooctane 1.2
    cyclopentanol 43.51
    tetrahydropyran 33.06
    tert-amyl methyl ether 13.25
    2,5,8-trioxanonane 65.92
    1-hexene 1.49
    2-isopropoxyethanol 52.34
    2,2,2-trifluoroethanol 50.94
    methyl butyrate 7.43

    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