alpha-Zeacarotene

  • Identifiers

    CAS number
    50657-19-7

    Molecular formula
    C40H58

    SMILES
    CC1=CCCC([C@H]1/C=C/C(=C/C=C/C(=C/C=C/C=C(\C)/C=C/C=C(\C)/CC/C=C(\C)/CCC=C(C)C)/C)/C)(C)C

    Safety labels

  • Odor profile

    Fragrance
    Woody 60.45%
    Balsamic 56.47%
    Floral 47.1%
    Sweet 42.44%
    Oily 39.07%
    Green 31.98%
    Tropical 30.8%
    Waxy 28.51%
    Sandalwood 27.16%
    Herbal 26.62%

     

    Flavor
    Balsam 51.73%
    Balsamic 37.06%
    Wood 31.95%
    Citrus 28.55%
    Oriental 27.6%
    Sweet 26.99%
    Spicy 24.84%
    Herbal 24.17%
    Woody 23.71%
    Diterpene 23.4%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    14.6

    pKa est.
    -5.87 (strong acid)

    Molecular weight
    538.9 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    579°C

    Flash point

    • 167.74 ˚C est.

  • Synonyms

    • alpha-Zeacarotene
    • 50657-19-7
    • DTXSID201317733
    • CHEBI:35063
    • RefChem:915579
    • DTXCID001747536
    • (6R)-6-[(1E,3E,5E,7E,9E,11E,13E,15E,19E)-3,7,12,16,20,24-hexamethylpentacosa-1,3,5,7,9,11,13,15,19,23-decaenyl]-1,5,5-trimethylcyclohexene
    • alpha-Zeacarotene/7',8'-Dihydro-delta-carotene
    • alpha-Zeacarotene/ 7',8'-Dihydro-delta-carotene
    • Zeacarotene
    • Zeacarotene, alpha-
    • (6R)-4,5-Didehydro-5,6,7',8'-tetrahydro-beta,psi-carotene
    • A5UH388E6T
    • 7',8'-Dihydro-b,?-carotene
    • SCHEMBL29596764
    • LMPR01070199
    • beta,psi-Carotene, 7',8'-dihydro-
    • FZ57837
    • (6R)-7',8'-Dihydro-epsilon,psi-carotene
    • epsilon,psi-Carotene, 7',8'-dihydro-, (6R)-
    • 50657-19-7
  • Applications

    alpha-Zeacarotene, CAS 50657-19-7, is primarily used as a natural colorant and food additive to provide yellow-orange coloration in foods, beverages, and cosmetic formulations, and it may be used as a carotenoid ingredient in dietary supplement formulations. It also serves as a pigment in cosmetics and personal care to enhance color in creams, oils, and other skin care products. As a carotenoid, it is used as a colorant in animal feed to color poultry products such as egg yolks and meat. In coatings and inks, alpha-zeacarotene can function as a natural pigment. It may also be considered for nutraceutical or supplement formulations, subject to local regulations and formulation limits.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 0.44
    methanol 0.37
    isopropanol 0.14
    water 0.0
    ethyl acetate 4.49
    n-propanol 0.65
    acetone 0.93
    n-butanol 1.04
    acetonitrile 0.18
    DMF 1.42
    toluene 13.51
    isobutanol 0.46
    1,4-dioxane 5.64
    methyl acetate 1.64
    THF 20.36
    2-butanone 3.54
    n-pentanol 1.36
    sec-butanol 0.56
    n-hexane 2.14
    ethylene glycol 0.01
    NMP 9.6
    cyclohexane 2.84
    DMSO 0.85
    n-butyl acetate 10.52
    n-octanol 1.23
    chloroform 23.54
    n-propyl acetate 5.43
    acetic acid 0.49
    dichloromethane 19.82
    cyclohexanone 10.77
    propylene glycol 0.03
    isopropyl acetate 4.69
    DMAc 7.39
    2-ethoxyethanol 1.68
    isopentanol 1.11
    n-heptane 3.08
    ethyl formate 1.1
    1,2-dichloroethane 7.67
    n-hexanol 1.87
    2-methoxyethanol 0.93
    isobutyl acetate 5.97
    tetrachloromethane 3.18
    n-pentyl acetate 8.14
    transcutol 16.63
    n-heptanol 1.6
    ethylbenzene 9.39
    MIBK 4.45
    2-propoxyethanol 3.67
    tert-butanol 0.26
    MTBE 4.29
    2-butoxyethanol 3.69
    propionic acid 0.56
    o-xylene 7.22
    formic acid 0.11
    diethyl ether 5.19
    m-xylene 8.64
    p-xylene 7.49
    chlorobenzene 10.07
    dimethyl carbonate 1.08
    n-octane 0.73
    formamide 0.16
    cyclopentanone 8.72
    2-pentanone 4.26
    anisole 12.83
    cyclopentyl methyl ether 15.21
    gamma-butyrolactone 6.8
    1-methoxy-2-propanol 1.04
    pyridine 9.39
    3-pentanone 5.65
    furfural 6.32
    n-dodecane 0.32
    diethylene glycol 0.42
    diisopropyl ether 2.44
    tert-amyl alcohol 1.12
    acetylacetone 4.13
    n-hexadecane 0.4
    acetophenone 9.75
    methyl propionate 3.3
    isopentyl acetate 13.87
    trichloroethylene 19.5
    n-nonanol 1.85
    cyclohexanol 1.8
    benzyl alcohol 2.47
    2-ethylhexanol 3.95
    isooctanol 2.11
    dipropyl ether 15.11
    1,2-dichlorobenzene 11.93
    ethyl lactate 1.26
    propylene carbonate 4.74
    n-methylformamide 0.4
    2-pentanol 0.7
    n-pentane 1.01
    1-propoxy-2-propanol 4.36
    1-methoxy-2-propyl acetate 12.32
    2-(2-methoxypropoxy) propanol 8.76
    mesitylene 4.97
    ε-caprolactone 13.19
    p-cymene 7.34
    epichlorohydrin 11.85
    1,1,1-trichloroethane 8.43
    2-aminoethanol 0.05
    morpholine-4-carbaldehyde 7.12
    sulfolane 8.34
    2,2,4-trimethylpentane 1.71
    2-methyltetrahydrofuran 16.94
    n-hexyl acetate 8.64
    isooctane 0.73
    2-(2-butoxyethoxy)ethanol 7.51
    sec-butyl acetate 8.5
    tert-butyl acetate 9.12
    decalin 2.91
    glycerin 0.07
    diglyme 20.75
    acrylic acid 0.37
    isopropyl myristate 5.01
    n-butyric acid 2.17
    acetyl acetate 2.93
    di(2-ethylhexyl) phthalate 4.59
    ethyl propionate 7.12
    nitromethane 0.88
    1,2-diethoxyethane 14.59
    benzonitrile 1.94
    trioctyl phosphate 2.09
    1-bromopropane 9.73
    gamma-valerolactone 13.24
    n-decanol 1.18
    triethyl phosphate 9.92
    4-methyl-2-pentanol 0.91
    propionitrile 0.58
    vinylene carbonate 3.98
    1,1,2-trichlorotrifluoroethane 4.43
    DMS 3.39
    cumene 6.14
    2-octanol 1.08
    2-hexanone 6.66
    octyl acetate 4.62
    limonene 10.6
    1,2-dimethoxyethane 7.44
    ethyl orthosilicate 14.04
    tributyl phosphate 3.01
    diacetone alcohol 3.2
    N,N-dimethylaniline 11.9
    acrylonitrile 0.48
    aniline 3.32
    1,3-propanediol 0.2
    bromobenzene 16.77
    dibromomethane 13.71
    1,1,2,2-tetrachloroethane 15.78
    2-methyl-cyclohexyl acetate 19.29
    tetrabutyl urea 4.75
    diisobutyl methanol 2.79
    2-phenylethanol 4.15
    styrene 8.32
    dioctyl adipate 9.13
    dimethyl sulfate 2.07
    ethyl butyrate 17.82
    methyl lactate 0.62
    butyl lactate 3.32
    diethyl carbonate 7.41
    propanediol butyl ether 1.33
    triethyl orthoformate 20.11
    p-tert-butyltoluene 7.02
    methyl 4-tert-butylbenzoate 14.6
    morpholine 6.19
    tert-butylamine 0.28
    n-dodecanol 0.79
    dimethoxymethane 2.83
    ethylene carbonate 3.15
    cyrene 7.5
    2-ethoxyethyl acetate 10.8
    2-ethylhexyl acetate 17.93
    1,2,4-trichlorobenzene 13.8
    4-methylpyridine 9.96
    dibutyl ether 7.93
    2,6-dimethyl-4-heptanol 2.79
    DEF 6.09
    dimethyl isosorbide 26.63
    tetrachloroethylene 9.03
    eugenol 6.44
    triacetin 9.18
    span 80 6.17
    1,4-butanediol 0.09
    1,1-dichloroethane 4.72
    2-methyl-1-pentanol 2.6
    methyl formate 0.37
    2-methyl-1-butanol 1.52
    n-decane 0.86
    butyronitrile 1.04
    3,7-dimethyl-1-octanol 2.24
    1-chlorooctane 3.48
    1-chlorotetradecane 1.11
    n-nonane 0.75
    undecane 0.49
    tert-butylcyclohexane 2.79
    cyclooctane 1.83
    cyclopentanol 1.01
    tetrahydropyran 13.21
    tert-amyl methyl ether 8.87
    2,5,8-trioxanonane 14.74
    1-hexene 5.09
    2-isopropoxyethanol 1.78
    2,2,2-trifluoroethanol 0.18
    methyl butyrate 7.55

    Scent© AI

1 of 4
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