14-Hydroxy-9-epi-beta-Caryophyllene

Overview IFRA Botanical Request a quote

  • Identifiers

    Molecular formula
    C15H24O

    SMILES
    C/C/1=C/CCC(=C)[C@@H]2CC([C@@H]2CC1)(C)CO

    Retention indicies (RI)

    • DB5: 1667.0

  • Odor profile

    Woody 54.07%
    Herbal 46.96%
    Floral 44.52%
    Citrus 42.52%
    Fresh 40.56%
    Fruity 38.13%
    Green 37.29%
    Spicy 35.51%
    Grapefruit 31.59%
    Clean 31.12%

    Scent© AI

  • Properties

    XLogP3-AA
    3.0

    Molecular weight
    220.35 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    345°C

    Flash point est.
    142.03 ˚C

  • Synonyms

    • 14-Hydroxy-9-epi-.beta.-Caryophyllene
    • DFMBJBXEHZSTJQ-KVBBHTPDSA-N

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 3080.46
    methanol 1669.16
    isopropanol 3317.98
    water 0.7
    ethyl acetate 2024.66
    n-propanol 2738.88
    acetone 2210.88
    n-butanol 2615.52
    acetonitrile 1593.43
    DMF 1397.89
    toluene 1095.19
    isobutanol 1705.9
    1,4-dioxane 2928.87
    methyl acetate 1357.84
    THF 4905.64
    2-butanone 1902.67
    n-pentanol 823.39
    sec-butanol 1494.52
    n-hexane 49.15
    ethylene glycol 161.81
    NMP 383.04
    cyclohexane 154.47
    DMSO 914.68
    n-butyl acetate 1160.78
    n-octanol 313.61
    chloroform 2643.77
    n-propyl acetate 817.12
    acetic acid 727.03
    dichloromethane 1838.09
    cyclohexanone 1382.54
    propylene glycol 410.12
    isopropyl acetate 1268.11
    DMAc 655.73
    2-ethoxyethanol 1047.18
    isopentanol 1773.15
    n-heptane 60.4
    ethyl formate 1048.62
    1,2-dichloroethane 1174.85
    n-hexanol 1203.79
    2-methoxyethanol 2703.46
    isobutyl acetate 515.25
    tetrachloromethane 365.92
    n-pentyl acetate 554.24
    transcutol 4138.85
    n-heptanol 397.04
    ethylbenzene 287.71
    MIBK 1003.9
    2-propoxyethanol 1744.87
    tert-butanol 2433.2
    MTBE 2426.84
    2-butoxyethanol 788.2
    propionic acid 729.85
    o-xylene 351.42
    formic acid 180.54
    diethyl ether 2735.89
    m-xylene 626.62
    p-xylene 314.99
    chlorobenzene 711.93
    dimethyl carbonate 399.77
    n-octane 19.73
    formamide 431.97
    cyclopentanone 1722.37
    2-pentanone 1848.75
    anisole 657.7
    cyclopentyl methyl ether 1452.0
    gamma-butyrolactone 1509.0
    1-methoxy-2-propanol 2368.6
    pyridine 1811.09
    3-pentanone 865.91
    furfural 988.41
    n-dodecane 13.19
    diethylene glycol 834.21
    diisopropyl ether 556.0
    tert-amyl alcohol 1133.52
    acetylacetone 1190.07
    n-hexadecane 15.88
    acetophenone 426.95
    methyl propionate 1195.51
    isopentyl acetate 989.64
    trichloroethylene 1880.69
    n-nonanol 263.48
    cyclohexanol 976.98
    benzyl alcohol 471.3
    2-ethylhexanol 478.29
    isooctanol 319.6
    dipropyl ether 837.72
    1,2-dichlorobenzene 486.26
    ethyl lactate 283.54
    propylene carbonate 757.93
    n-methylformamide 1028.46
    2-pentanol 1380.43
    n-pentane 119.32
    1-propoxy-2-propanol 1283.07
    1-methoxy-2-propyl acetate 1081.41
    2-(2-methoxypropoxy) propanol 519.55
    mesitylene 331.47
    ε-caprolactone 1065.98
    p-cymene 202.45
    epichlorohydrin 2183.28
    1,1,1-trichloroethane 1015.56
    2-aminoethanol 670.35
    morpholine-4-carbaldehyde 919.01
    sulfolane 743.32
    2,2,4-trimethylpentane 50.58
    2-methyltetrahydrofuran 2411.07
    n-hexyl acetate 663.7
    isooctane 78.61
    2-(2-butoxyethoxy)ethanol 927.7
    sec-butyl acetate 570.77
    tert-butyl acetate 1069.59
    decalin 47.77
    glycerin 456.43
    diglyme 1637.1
    acrylic acid 405.84
    isopropyl myristate 203.09
    n-butyric acid 1778.58
    acetyl acetate 697.38
    di(2-ethylhexyl) phthalate 181.29
    ethyl propionate 643.54
    nitromethane 1217.65
    1,2-diethoxyethane 1482.44
    benzonitrile 673.23
    trioctyl phosphate 135.92
    1-bromopropane 964.99
    gamma-valerolactone 1866.56
    n-decanol 178.69
    triethyl phosphate 180.4
    4-methyl-2-pentanol 734.25
    propionitrile 1644.42
    vinylene carbonate 736.46
    1,1,2-trichlorotrifluoroethane 788.95
    DMS 363.12
    cumene 183.13
    2-octanol 236.94
    2-hexanone 698.99
    octyl acetate 239.39
    limonene 266.31
    1,2-dimethoxyethane 1828.58
    ethyl orthosilicate 199.22
    tributyl phosphate 168.52
    diacetone alcohol 971.17
    N,N-dimethylaniline 309.82
    acrylonitrile 1322.75
    aniline 998.65
    1,3-propanediol 1537.26
    bromobenzene 723.04
    dibromomethane 1281.42
    1,1,2,2-tetrachloroethane 1307.61
    2-methyl-cyclohexyl acetate 358.52
    tetrabutyl urea 186.14
    diisobutyl methanol 351.58
    2-phenylethanol 605.29
    styrene 362.57
    dioctyl adipate 241.41
    dimethyl sulfate 302.09
    ethyl butyrate 688.79
    methyl lactate 429.75
    butyl lactate 387.1
    diethyl carbonate 363.1
    propanediol butyl ether 615.9
    triethyl orthoformate 430.46
    p-tert-butyltoluene 219.34
    methyl 4-tert-butylbenzoate 367.54
    morpholine 3693.89
    tert-butylamine 1566.27
    n-dodecanol 123.08
    dimethoxymethane 2093.3
    ethylene carbonate 737.86
    cyrene 308.63
    2-ethoxyethyl acetate 828.27
    2-ethylhexyl acetate 636.2
    1,2,4-trichlorobenzene 512.37
    4-methylpyridine 1526.42
    dibutyl ether 469.26
    2,6-dimethyl-4-heptanol 351.58
    DEF 970.34
    dimethyl isosorbide 705.52
    tetrachloroethylene 774.75
    eugenol 350.21
    triacetin 465.84
    span 80 400.56
    1,4-butanediol 287.62
    1,1-dichloroethane 1565.39
    2-methyl-1-pentanol 571.23
    methyl formate 643.71
    2-methyl-1-butanol 1215.65
    n-decane 28.27
    butyronitrile 2063.93
    3,7-dimethyl-1-octanol 381.38
    1-chlorooctane 154.95
    1-chlorotetradecane 46.44
    n-nonane 26.63
    undecane 18.28
    tert-butylcyclohexane 50.66
    cyclooctane 51.77
    cyclopentanol 938.08
    tetrahydropyran 3608.35
    tert-amyl methyl ether 864.43
    2,5,8-trioxanonane 861.42
    1-hexene 290.58
    2-isopropoxyethanol 676.96
    2,2,2-trifluoroethanol 199.36
    methyl butyrate 783.36

    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

Botanical

Name CAS Botanical Proportion
Geranium (Cuba) 8000-46-2 Pelargonium species, fam. Geraniaceae 0.5%
Baccharis coridifolia Baccharis coridifolia De Candole, fam. Asteraceae (Compositae) 2.8%
Inula verbascifolia ssp. parnassica Inula verbascifolia Hausskn., ssp. parnassia Tutin, fam. Asteraceae 0.01%
Sage, dalmatian (Italy) 9 8022-56-8 Salvia officinalis L., fam. Lamiaceae (Labiatae) 0.6%
Rosemary (Italy) 15 8000-25-7 Rosmarinus officinalis L., fam. Lamiaceae (Labiatae) 0.5%
Sage, ssp. altissima (Cuba) Salvia officinalis L. ssp. altissima, fam. Lamiaceae (Labiatae) 0.6%
Argyranthemum adauctum ssp. erythrocarpon Argyranthemum adauctum ssp. erythrocarpon Humphries, fam. Asteraceae 1.8%