5-((8Z,11Z)-Pentadeca-8,11,14-trien-1-yl)benzene-1,3-diol

  • Identifiers

    CAS number
    79473-24-8

    Molecular formula
    C21H30O2

    SMILES
    C=CC/C=C\C/C=C\CCCCCCCC1=CC(=CC(=C1)O)O

    Safety labels

  • Odor profile

    Fragrance
    Fatty 51.44%
    Oily 40.06%
    Waxy 38.66%
    Spicy 32.04%
    Woody 30.94%
    Balsamic 27.19%
    Meaty 25.49%
    Fruity 24.24%
    Sweet 23.07%
    Savory 22.58%

     

    Flavor
    Faint 20.64%
    Diterpene 20.58%
    Oriental 20.57%
    Low 20.26%
    Terpentine 20.08%
    Delicate 19.61%
    Nitrile 19.24%
    Opoponax 19.0%
    Slightly waxy 18.94%
    Citric 18.53%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    7.2

    pKa est.
    9.32 (weak base)

    Molecular weight
    314.5 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    417°C

    Flash point

    • 222.42 ˚C est.

  • Synonyms

    • Cardol triene
    • 5-(pentadeca-8,11,14-trien-1-yl)resorcinol
    • 5-[(8Z,11Z)-pentadeca-8,11,14-trienyl]benzene-1,3-diol
    • 5-[(8Z,11Z)-pentadeca-8,11,14-trien-1-yl]benzene-1,3-diol
    • CHEBI:52680
    • DTXSID30872873
    • 5-((8Z,11Z)-pentadeca-8,11,14-trien-1-yl)benzene-1,3-diol
    • 5-((8Z,11Z)-pentadeca-8,11,14-trienyl)benzene-1,3-diol
    • RefChem:1072317
    • DTXCID20820429
    • 79473-24-8
    • CHEMBL459603
    • 5-(8Z,11Z,14-Pentadecatrienyl)resorcinol
    • 1,3-Benzenediol,5-(8Z,11Z)-8,11,14-pentadecatrien-1-yl-
    • (8Z,11Z)-5-(pentadeca-8,11,14-trien-1-yl)resorcinol
    • 5-pentadecatrienyl resorcinol
    • MEGxp0_000811
    • orb1694334
    • SCHEMBL2467234
    • ACon1_000596
    • 1,3-Benzenediol, 5-(8Z,11Z)-8,11,14-pentadecatrienyl-
    • BDBM50292425
    • LMPK15030022
    • MFCD27967678
    • AKOS040754814
    • NCGC00168928-01
    • NCGC00168928-02
    • HY-101258
    • CS-0021053
    • BRD-K89787085-001-01-7
    • Q27123547
    • 1,3-Benzenediol,5-(8Z,11Z)-8,11,14-pentadecatrienyl-
    • 5-((8Z,11Z)-pentadeca-8,11,14-trien-1-yl)resorcinol
    • 79473-24-8
  • Applications

    5-((8Z,11Z)-Pentadeca-8,11,14-trien-1-yl)benzene-1,3-diol is typically used as a synthetic intermediate for colorants and pigments, supporting applications in coatings, inks, and plastics to introduce color and optical stability. It may also serve as a cosmetic/personal care colorant or color additive in formulated products. The phenolic structure and the polyene chain suggest potential as an antioxidant or polymer stabilizer, so it can be considered as a stabilizing additive in polymer systems and films. In broader industrial manufacturing, it can function as a precursor to more complex organic molecules or specialty materials, subject to formulation constraints and regulatory limits.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 1992.21
    methanol 1229.02
    isopropanol 1181.1
    water 0.02
    ethyl acetate 679.54
    n-propanol 1336.97
    acetone 2698.27
    n-butanol 903.43
    acetonitrile 268.62
    DMF 1208.43
    toluene 142.38
    isobutanol 692.66
    1,4-dioxane 1053.11
    methyl acetate 460.84
    THF 4697.93
    2-butanone 1165.49
    n-pentanol 455.69
    sec-butanol 723.96
    n-hexane 22.28
    ethylene glycol 41.16
    NMP 675.72
    cyclohexane 54.36
    DMSO 3572.25
    n-butyl acetate 360.19
    n-octanol 102.01
    chloroform 432.53
    n-propyl acetate 396.64
    acetic acid 400.92
    dichloromethane 506.56
    cyclohexanone 1167.98
    propylene glycol 198.98
    isopropyl acetate 436.33
    DMAc 898.68
    2-ethoxyethanol 661.4
    isopentanol 594.31
    n-heptane 16.39
    ethyl formate 283.86
    1,2-dichloroethane 665.82
    n-hexanol 301.08
    2-methoxyethanol 1490.83
    isobutyl acetate 253.62
    tetrachloromethane 69.37
    n-pentyl acetate 219.33
    transcutol 1863.31
    n-heptanol 117.76
    ethylbenzene 60.31
    MIBK 511.5
    2-propoxyethanol 661.38
    tert-butanol 956.95
    MTBE 851.65
    2-butoxyethanol 312.42
    propionic acid 323.76
    o-xylene 70.24
    formic acid 69.39
    diethyl ether 926.31
    m-xylene 88.89
    p-xylene 68.07
    chlorobenzene 161.05
    dimethyl carbonate 157.8
    n-octane 6.99
    formamide 173.97
    cyclopentanone 1703.65
    2-pentanone 1130.15
    anisole 196.02
    cyclopentyl methyl ether 889.36
    gamma-butyrolactone 1124.25
    1-methoxy-2-propanol 1112.81
    pyridine 521.19
    3-pentanone 471.91
    furfural 468.33
    n-dodecane 5.91
    diethylene glycol 306.75
    diisopropyl ether 154.45
    tert-amyl alcohol 565.73
    acetylacetone 879.08
    n-hexadecane 7.04
    acetophenone 186.7
    methyl propionate 495.78
    isopentyl acetate 333.98
    trichloroethylene 748.4
    n-nonanol 99.24
    cyclohexanol 538.65
    benzyl alcohol 173.6
    2-ethylhexanol 153.19
    isooctanol 113.91
    dipropyl ether 293.43
    1,2-dichlorobenzene 123.51
    ethyl lactate 148.48
    propylene carbonate 406.17
    n-methylformamide 505.64
    2-pentanol 457.4
    n-pentane 24.66
    1-propoxy-2-propanol 496.94
    1-methoxy-2-propyl acetate 436.14
    2-(2-methoxypropoxy) propanol 256.24
    mesitylene 54.38
    ε-caprolactone 678.18
    p-cymene 44.44
    epichlorohydrin 1477.97
    1,1,1-trichloroethane 368.27
    2-aminoethanol 250.84
    morpholine-4-carbaldehyde 601.56
    sulfolane 1429.61
    2,2,4-trimethylpentane 17.7
    2-methyltetrahydrofuran 1722.14
    n-hexyl acetate 266.73
    isooctane 16.2
    2-(2-butoxyethoxy)ethanol 454.03
    sec-butyl acetate 245.2
    tert-butyl acetate 515.2
    decalin 20.62
    glycerin 189.99
    diglyme 828.26
    acrylic acid 149.53
    isopropyl myristate 96.78
    n-butyric acid 775.4
    acetyl acetate 241.35
    di(2-ethylhexyl) phthalate 76.38
    ethyl propionate 264.69
    nitromethane 760.45
    1,2-diethoxyethane 561.03
    benzonitrile 145.02
    trioctyl phosphate 65.25
    1-bromopropane 352.29
    gamma-valerolactone 1418.51
    n-decanol 68.86
    triethyl phosphate 96.26
    4-methyl-2-pentanol 212.88
    propionitrile 261.73
    vinylene carbonate 235.39
    1,1,2-trichlorotrifluoroethane 582.62
    DMS 171.39
    cumene 44.94
    2-octanol 76.92
    2-hexanone 492.55
    octyl acetate 119.4
    limonene 87.89
    1,2-dimethoxyethane 1039.67
    ethyl orthosilicate 108.24
    tributyl phosphate 84.76
    diacetone alcohol 650.33
    N,N-dimethylaniline 119.83
    acrylonitrile 217.47
    aniline 241.49
    1,3-propanediol 576.74
    bromobenzene 141.07
    dibromomethane 323.26
    1,1,2,2-tetrachloroethane 675.3
    2-methyl-cyclohexyl acetate 189.03
    tetrabutyl urea 119.96
    diisobutyl methanol 98.11
    2-phenylethanol 165.82
    styrene 75.38
    dioctyl adipate 148.07
    dimethyl sulfate 277.6
    ethyl butyrate 253.61
    methyl lactate 236.31
    butyl lactate 190.91
    diethyl carbonate 130.45
    propanediol butyl ether 275.06
    triethyl orthoformate 181.7
    p-tert-butyltoluene 45.51
    methyl 4-tert-butylbenzoate 185.91
    morpholine 1779.46
    tert-butylamine 432.37
    n-dodecanol 50.76
    dimethoxymethane 1259.71
    ethylene carbonate 255.97
    cyrene 215.76
    2-ethoxyethyl acetate 323.04
    2-ethylhexyl acetate 223.74
    1,2,4-trichlorobenzene 157.94
    4-methylpyridine 410.06
    dibutyl ether 206.43
    2,6-dimethyl-4-heptanol 98.11
    DEF 600.39
    dimethyl isosorbide 460.19
    tetrachloroethylene 358.81
    eugenol 162.22
    triacetin 233.01
    span 80 208.15
    1,4-butanediol 123.6
    1,1-dichloroethane 499.17
    2-methyl-1-pentanol 313.4
    methyl formate 287.21
    2-methyl-1-butanol 510.34
    n-decane 11.9
    butyronitrile 418.56
    3,7-dimethyl-1-octanol 124.98
    1-chlorooctane 68.3
    1-chlorotetradecane 23.17
    n-nonane 10.81
    undecane 7.99
    tert-butylcyclohexane 20.09
    cyclooctane 12.3
    cyclopentanol 668.25
    tetrahydropyran 1937.3
    tert-amyl methyl ether 418.39
    2,5,8-trioxanonane 484.48
    1-hexene 127.77
    2-isopropoxyethanol 416.93
    2,2,2-trifluoroethanol 67.68
    methyl butyrate 399.97

    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