Gingerenone A

Overview IFRA Request a quote

  • Identifiers

    CAS number
    128700-97-0

    Molecular formula
    C21H24O5

    SMILES
    COC1=C(C=CC(=C1)CC/C=C/C(=O)CCC2=CC(=C(C=C2)O)OC)O

    Safety labels

  • Odor profile

    Fragrance
    Spicy 62.78%
    Vanilla 53.55%
    Sweet 50.25%
    Balsamic 44.42%
    Warm 32.9%
    Creamy 30.41%
    Powdery 28.87%
    Clove 28.79%
    Savory 28.5%
    Woody 28.09%

     

    Flavor
    Spicy 38.55%
    Sweet 37.53%
    Woody 37.28%
    Bitter 32.4%
    Spice 27.8%
    Clove 26.77%
    Floral 26.25%
    Herbal 25.3%
    Mild 24.82%
    Odorless 23.76%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    3.7

    pKa est.
    10.83 (weak base)

    Molecular weight
    356.4 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    580°C

    Flash point

    • 207.67 ˚C est.

  • Synonyms

    • Gingerenone A
    • 128700-97-0
    • (E)-1,7-bis(4-hydroxy-3-methoxyphenyl)hept-4-en-3-one
    • (4E)-1,7-bis(4-hydroxy-3-methoxyphenyl)hept-4-en-3-one
    • RefChem:922215
    • 1,7-bis(4-hydroxy-3-methoxyphenyl)hept-4-en-3-one
    • AS-HK014
    • 4-Hepten-3-one, 1,7-bis(4-hydroxy-3-methoxyphenyl)-, (4E)-
    • (4E)-1,7-Bis(4-hydroxy-3-methoxyphenyl)-4-hepten-3-one
    • (E)-1,7-bis(4-hydroxy-3-methoxy-phenyl)hept-4-en-3-one
    • 79067-88-2
    • (E)-Gingerenone A
    • Gingerone A
    • Gingerenone A?
    • (4E)-1,7-bis(4-Hydroxy-3-methoxyphenyl)-4-hepten-3-one; (E)-1,7-bis(4-Hydroxy-3-methoxyphenyl)-4-hepten-3-one;
    • 4-Hepten-3-one, 1,7-bis(4-hydroxy-3-methoxyphenyl)-
    • CHEBI:5352
    • orb1680964
    • SCHEMBL4740686
    • CHEMBL1086746
    • SCHEMBL29539781
    • DTXSID50873741
    • FWDXZNKYDTXGOT-GQCTYLIASA-N
    • GLXC-05676
    • EX-A7649
    • AKOS028112802
    • EBC-615780
    • AC-36929
    • DA-73720
    • FG164956
    • HY-120912
    • CS-0079572
    • G15837
    • 1,7-bis-(4-hydroxy-3-methoxyphenyl)hept-4-en-3-one
    • Q27106727
    • 1,7-Bis(4-hydroxy-3-methoxyphenyl)-4-hepten-3-one, 9CI
    • 1,7-bis-(4'-hydroxy-3'-methoxyphenyl)-4-heptene-3-one
    • (E)-1,7-bis-(4'-hydroxy-3'-methoxyphenyl)-4-hepten-3-one
    • 4-Hepten-3-one, 1,7-bis(4-hydroxy-3-methoxyphenyl)-, (E)-
    • 128700-97-0

  • Applications

    Gingerenone A (CAS 128700-97-0) is a natural diarylheptanoid found in ginger. In practical terms, it is often evaluated as an intermediate in organic synthesis and as a scaffold for the development of bioactive compounds in pharmaceutical research. It is commonly studied for its antioxidant activity and other biological properties, informing cosmetics and personal care research as a potential antioxidant or functional ingredient. It may be explored as a lead structure in agrochemical research and in polymer or materials science as a building block for specialty chemicals. Additionally, it can serve as a research reagent in analytical chemistry and as a reference material in natural-product chemistry.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 10.65
    methanol 10.39
    isopropanol 14.14
    water 0.01
    ethyl acetate 20.44
    n-propanol 16.63
    acetone 73.49
    n-butanol 9.03
    acetonitrile 11.56
    DMF 45.9
    toluene 8.04
    isobutanol 7.7
    1,4-dioxane 87.82
    methyl acetate 26.84
    THF 644.56
    2-butanone 47.29
    n-pentanol 10.27
    sec-butanol 15.49
    n-hexane 1.06
    ethylene glycol 3.32
    NMP 19.41
    cyclohexane 2.46
    DMSO 612.34
    n-butyl acetate 6.99
    n-octanol 6.16
    chloroform 58.01
    n-propyl acetate 10.62
    acetic acid 23.76
    dichloromethane 65.68
    cyclohexanone 50.65
    propylene glycol 7.51
    isopropyl acetate 12.03
    DMAc 73.02
    2-ethoxyethanol 35.87
    isopentanol 6.73
    n-heptane 1.31
    ethyl formate 11.02
    1,2-dichloroethane 46.48
    n-hexanol 6.96
    2-methoxyethanol 41.46
    isobutyl acetate 6.4
    tetrachloromethane 4.85
    n-pentyl acetate 10.22
    transcutol 56.18
    n-heptanol 6.42
    ethylbenzene 4.83
    MIBK 12.37
    2-propoxyethanol 26.52
    tert-butanol 21.07
    MTBE 16.87
    2-butoxyethanol 18.04
    propionic acid 14.71
    o-xylene 4.75
    formic acid 7.57
    diethyl ether 21.2
    m-xylene 3.27
    p-xylene 5.41
    chlorobenzene 8.56
    dimethyl carbonate 14.42
    n-octane 1.05
    formamide 21.41
    cyclopentanone 111.58
    2-pentanone 26.16
    anisole 14.04
    cyclopentyl methyl ether 30.61
    gamma-butyrolactone 79.48
    1-methoxy-2-propanol 30.46
    pyridine 36.97
    3-pentanone 22.97
    furfural 33.97
    n-dodecane 0.83
    diethylene glycol 19.02
    diisopropyl ether 4.1
    tert-amyl alcohol 15.71
    acetylacetone 44.44
    n-hexadecane 0.95
    acetophenone 14.5
    methyl propionate 21.24
    isopentyl acetate 8.31
    trichloroethylene 66.2
    n-nonanol 7.32
    cyclohexanol 12.5
    benzyl alcohol 12.1
    2-ethylhexanol 4.99
    isooctanol 6.09
    dipropyl ether 10.83
    1,2-dichlorobenzene 8.6
    ethyl lactate 8.39
    propylene carbonate 16.03
    n-methylformamide 17.31
    2-pentanol 7.11
    n-pentane 0.76
    1-propoxy-2-propanol 18.09
    1-methoxy-2-propyl acetate 16.68
    2-(2-methoxypropoxy) propanol 19.3
    mesitylene 2.2
    ε-caprolactone 27.81
    p-cymene 3.05
    epichlorohydrin 115.45
    1,1,1-trichloroethane 21.9
    2-aminoethanol 7.42
    morpholine-4-carbaldehyde 35.07
    sulfolane 110.75
    2,2,4-trimethylpentane 0.7
    2-methyltetrahydrofuran 69.62
    n-hexyl acetate 12.19
    isooctane 0.39
    2-(2-butoxyethoxy)ethanol 25.22
    sec-butyl acetate 7.16
    tert-butyl acetate 16.31
    decalin 1.17
    glycerin 11.41
    diglyme 55.13
    acrylic acid 13.69
    isopropyl myristate 6.43
    n-butyric acid 13.42
    acetyl acetate 15.57
    di(2-ethylhexyl) phthalate 6.28
    ethyl propionate 11.19
    nitromethane 66.01
    1,2-diethoxyethane 24.63
    benzonitrile 9.55
    trioctyl phosphate 4.97
    1-bromopropane 15.66
    gamma-valerolactone 73.68
    n-decanol 5.71
    triethyl phosphate 7.86
    4-methyl-2-pentanol 3.94
    propionitrile 13.49
    vinylene carbonate 15.26
    1,1,2-trichlorotrifluoroethane 42.5
    DMS 14.15
    cumene 3.13
    2-octanol 4.91
    2-hexanone 15.75
    octyl acetate 8.05
    limonene 4.27
    1,2-dimethoxyethane 63.73
    ethyl orthosilicate 7.96
    tributyl phosphate 5.92
    diacetone alcohol 22.9
    N,N-dimethylaniline 9.28
    acrylonitrile 15.96
    aniline 10.73
    1,3-propanediol 12.99
    bromobenzene 8.28
    dibromomethane 34.85
    1,1,2,2-tetrachloroethane 56.16
    2-methyl-cyclohexyl acetate 9.63
    tetrabutyl urea 9.63
    diisobutyl methanol 4.29
    2-phenylethanol 10.58
    styrene 5.56
    dioctyl adipate 11.45
    dimethyl sulfate 28.94
    ethyl butyrate 8.32
    methyl lactate 12.47
    butyl lactate 9.31
    diethyl carbonate 6.7
    propanediol butyl ether 13.05
    triethyl orthoformate 9.99
    p-tert-butyltoluene 2.93
    methyl 4-tert-butylbenzoate 15.82
    morpholine 86.94
    tert-butylamine 7.55
    n-dodecanol 4.5
    dimethoxymethane 58.2
    ethylene carbonate 13.57
    cyrene 21.43
    2-ethoxyethyl acetate 19.36
    2-ethylhexyl acetate 5.97
    1,2,4-trichlorobenzene 11.16
    4-methylpyridine 17.25
    dibutyl ether 10.55
    2,6-dimethyl-4-heptanol 4.29
    DEF 19.57
    dimethyl isosorbide 34.24
    tetrachloroethylene 30.67
    eugenol 15.09
    triacetin 16.94
    span 80 13.64
    1,4-butanediol 6.88
    1,1-dichloroethane 24.06
    2-methyl-1-pentanol 8.05
    methyl formate 17.07
    2-methyl-1-butanol 6.98
    n-decane 1.61
    butyronitrile 9.61
    3,7-dimethyl-1-octanol 5.86
    1-chlorooctane 4.92
    1-chlorotetradecane 2.26
    n-nonane 1.36
    undecane 1.1
    tert-butylcyclohexane 0.87
    cyclooctane 0.83
    cyclopentanol 21.96
    tetrahydropyran 81.55
    tert-amyl methyl ether 12.23
    2,5,8-trioxanonane 40.52
    1-hexene 4.11
    2-isopropoxyethanol 22.46
    2,2,2-trifluoroethanol 9.76
    methyl butyrate 13.02

    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