Sargachromanol A

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  • Identifiers

    CAS number
    856414-50-1

    Molecular formula
    C22H30O3

    SMILES
    CC1=CC(=CC2=C1O[C@](CC2)(C)CC/C=C(\C)/CC/C=C(\C)/C=O)O

    Safety labels

  • Odor profile

    Fragrance
    Floral 61.97%
    Sweet 46.62%
    Fruity 43.04%
    Woody 39.28%
    Fresh 38.72%
    Powdery 35.29%
    Waxy 29.25%
    Dry 29.14%
    Spicy 26.9%
    Orris 26.64%

     

    Flavor
    Woody 50.59%
    Herbal 44.74%
    Floral 40.55%
    Spicy 36.31%
    Spice 31.65%
    Wood 29.5%
    Fresh 27.83%
    Flower 24.45%
    Minty 23.79%
    Warm 22.43%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    5.4

    pKa est.
    9.64 (weak base)

    Molecular weight
    342.5 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    567°C

    Flash point

    • 186.2 ˚C est.

  • Synonyms

    • Sargachromanol A
    • Sargasol A
    • Sargachromanol A, (+)-
    • UNII-3OG14YJA8B
    • 3OG14YJA8B
    • 856414-50-1
    • 2,6-Nonadienal, 9-((2R)-3,4-dihydro-6-hydroxy-2,8-dimethyl-2H-1-benzopyran-2-yl)-2,6-dimethyl-, (2E,6E)-
    • DTXSID40234887
    • (2E,6E)-9-((2R)-6-hydroxy-2,8-dimethyl-3,4-dihydrochromen-2-yl)-2,6-dimethylnona-2,6-dienal
    • (2E,6E)-9-[(2R)-6-hydroxy-2,8-dimethyl-3,4-dihydrochromen-2-yl]-2,6-dimethylnona-2,6-dienal
    • RefChem:181401
    • SARGACHROMANOL A [INCI]
    • DTXCID70157378
    • CHEMBL463336
    • SCHEMBL31397013
    • BDBM50483662
    • (2E,6E)-9-[(2R)-6-hydroxy-2,8-dimethyl-3,4-dihydro-2H-1-benzopyran-2-yl]-2,6-dimethylnona-2,6-dienal
    • Q27257819
    • 856414-50-1

  • Applications

    Sargachromanol A (CAS 856414-50-1) is a natural compound that has drawn interest for a range of industrial applications. In cosmetics and personal care, it is evaluated as an antioxidant and has potential to act as a stabilizer for formulations, helping to extend product shelf life. In polymers and coatings, Sargachromanol A can be used as an antioxidant/oxidative stabilizer additive to improve durability under light and oxygen exposure. In industrial manufacturing, it may serve as an intermediate or a specialty building block for organic synthesis. Additionally, reports of in vitro biological activity suggest it may be of interest for pharmaceutical research or as a research reagent, subject to local regulations.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 53.39
    methanol 44.74
    isopropanol 37.13
    water 0.02
    ethyl acetate 94.62
    n-propanol 62.29
    acetone 49.29
    n-butanol 71.79
    acetonitrile 25.18
    DMF 45.89
    toluene 79.85
    isobutanol 42.98
    1,4-dioxane 203.71
    methyl acetate 73.48
    THF 339.06
    2-butanone 109.7
    n-pentanol 68.96
    sec-butanol 49.55
    n-hexane 2.04
    ethylene glycol 1.71
    NMP 43.56
    cyclohexane 4.77
    DMSO 67.12
    n-butyl acetate 98.92
    n-octanol 27.84
    chloroform 398.41
    n-propyl acetate 87.42
    acetic acid 32.23
    dichloromethane 316.24
    cyclohexanone 141.41
    propylene glycol 6.4
    isopropyl acetate 66.31
    DMAc 154.46
    2-ethoxyethanol 117.63
    isopentanol 65.61
    n-heptane 2.3
    ethyl formate 39.08
    1,2-dichloroethane 140.06
    n-hexanol 62.06
    2-methoxyethanol 87.08
    isobutyl acetate 73.46
    tetrachloromethane 21.0
    n-pentyl acetate 73.26
    transcutol 472.37
    n-heptanol 33.86
    ethylbenzene 40.11
    MIBK 69.61
    2-propoxyethanol 145.03
    tert-butanol 46.38
    MTBE 84.59
    2-butoxyethanol 87.78
    propionic acid 28.77
    o-xylene 38.01
    formic acid 8.36
    diethyl ether 86.4
    m-xylene 44.13
    p-xylene 45.45
    chlorobenzene 90.24
    dimethyl carbonate 23.89
    n-octane 1.38
    formamide 15.74
    cyclopentanone 108.81
    2-pentanone 86.92
    anisole 110.74
    cyclopentyl methyl ether 91.39
    gamma-butyrolactone 92.28
    1-methoxy-2-propanol 82.65
    pyridine 138.42
    3-pentanone 68.87
    furfural 104.7
    n-dodecane 1.6
    diethylene glycol 53.58
    diisopropyl ether 19.31
    tert-amyl alcohol 49.81
    acetylacetone 78.3
    n-hexadecane 1.92
    acetophenone 88.03
    methyl propionate 63.34
    isopentyl acetate 110.13
    trichloroethylene 305.54
    n-nonanol 30.79
    cyclohexanol 48.82
    benzyl alcohol 72.76
    2-ethylhexanol 43.06
    isooctanol 32.17
    dipropyl ether 47.29
    1,2-dichlorobenzene 78.42
    ethyl lactate 38.05
    propylene carbonate 59.18
    n-methylformamide 22.26
    2-pentanol 39.93
    n-pentane 1.63
    1-propoxy-2-propanol 97.11
    1-methoxy-2-propyl acetate 118.97
    2-(2-methoxypropoxy) propanol 97.63
    mesitylene 22.62
    ε-caprolactone 126.67
    p-cymene 23.81
    epichlorohydrin 217.08
    1,1,1-trichloroethane 103.43
    2-aminoethanol 10.21
    morpholine-4-carbaldehyde 120.33
    sulfolane 83.95
    2,2,4-trimethylpentane 3.03
    2-methyltetrahydrofuran 153.43
    n-hexyl acetate 90.25
    isooctane 2.15
    2-(2-butoxyethoxy)ethanol 139.19
    sec-butyl acetate 72.56
    tert-butyl acetate 75.31
    decalin 4.57
    glycerin 10.25
    diglyme 266.11
    acrylic acid 19.0
    isopropyl myristate 37.29
    n-butyric acid 68.44
    acetyl acetate 48.15
    di(2-ethylhexyl) phthalate 43.39
    ethyl propionate 68.42
    nitromethane 55.01
    1,2-diethoxyethane 168.01
    benzonitrile 68.62
    trioctyl phosphate 25.83
    1-bromopropane 84.29
    gamma-valerolactone 181.51
    n-decanol 22.54
    triethyl phosphate 42.68
    4-methyl-2-pentanol 30.23
    propionitrile 41.96
    vinylene carbonate 64.85
    1,1,2-trichlorotrifluoroethane 94.94
    DMS 62.24
    cumene 26.68
    2-octanol 21.63
    2-hexanone 93.87
    octyl acetate 45.5
    limonene 29.65
    1,2-dimethoxyethane 203.78
    ethyl orthosilicate 47.45
    tributyl phosphate 33.91
    diacetone alcohol 72.13
    N,N-dimethylaniline 62.39
    acrylonitrile 38.57
    aniline 66.89
    1,3-propanediol 30.85
    bromobenzene 99.29
    dibromomethane 160.6
    1,1,2,2-tetrachloroethane 233.61
    2-methyl-cyclohexyl acetate 78.49
    tetrabutyl urea 43.71
    diisobutyl methanol 23.34
    2-phenylethanol 82.46
    styrene 49.93
    dioctyl adipate 59.88
    dimethyl sulfate 31.4
    ethyl butyrate 72.88
    methyl lactate 24.04
    butyl lactate 53.71
    diethyl carbonate 48.75
    propanediol butyl ether 57.54
    triethyl orthoformate 68.33
    p-tert-butyltoluene 22.15
    methyl 4-tert-butylbenzoate 78.75
    morpholine 219.11
    tert-butylamine 23.87
    n-dodecanol 16.79
    dimethoxymethane 102.95
    ethylene carbonate 57.61
    cyrene 81.68
    2-ethoxyethyl acetate 123.72
    2-ethylhexyl acetate 88.97
    1,2,4-trichlorobenzene 97.01
    4-methylpyridine 142.14
    dibutyl ether 48.95
    2,6-dimethyl-4-heptanol 23.34
    DEF 78.86
    dimethyl isosorbide 173.85
    tetrachloroethylene 119.82
    eugenol 83.04
    triacetin 97.17
    span 80 71.03
    1,4-butanediol 16.27
    1,1-dichloroethane 119.76
    2-methyl-1-pentanol 70.81
    methyl formate 16.89
    2-methyl-1-butanol 61.08
    n-decane 3.11
    butyronitrile 57.13
    3,7-dimethyl-1-octanol 37.62
    1-chlorooctane 20.61
    1-chlorotetradecane 7.53
    n-nonane 2.43
    undecane 2.14
    tert-butylcyclohexane 4.49
    cyclooctane 1.76
    cyclopentanol 32.0
    tetrahydropyran 195.03
    tert-amyl methyl ether 60.76
    2,5,8-trioxanonane 180.17
    1-hexene 17.23
    2-isopropoxyethanol 95.6
    2,2,2-trifluoroethanol 9.37
    methyl butyrate 88.3

    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