gamma-Guaiene

Overview IFRA Botanical Request a quote

  • Identifiers

    CAS number
    111900-51-7

    Molecular formula
    C15H24

    SMILES
    C[C@@H]1CCC(=CC2=C1CC[C@H]2C)C(C)C

  • Odor profile

    Woody 79.22%
    Spicy 66.69%
    Herbal 55.44%
    Sweet 43.4%
    Balsamic 41.39%
    Fresh 40.15%
    Terpenic 39.0%
    Dry 38.69%
    Citrus 37.84%
    Camphoreous 32.62%

    Scent© AI

  • Properties

    XLogP3-AA
    4.0

    Molecular weight
    204.35 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Slow

    Boiling point est.
    270°C

    Flash point est.
    83.6 ˚C

  • Synonyms

    • .gamma.-guaiene
    • YLPOFTFBOIPYLE-VXGBXAGGSA-N
    • DTXSID201163190
    • 111900-51-7
    • (1R,4R)-1,2,3,4,5,6-Hexahydro-1,4-dimethyl-7-(1-methylethyl)azulene

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 80.11
    methanol 28.82
    isopropanol 107.77
    water 0.04
    ethyl acetate 303.01
    n-propanol 116.35
    acetone 268.56
    n-butanol 151.94
    acetonitrile 136.55
    DMF 242.34
    toluene 696.79
    isobutanol 120.51
    1,4-dioxane 686.76
    methyl acetate 248.1
    THF 1172.39
    2-butanone 382.71
    n-pentanol 122.51
    sec-butanol 139.7
    n-hexane 188.04
    ethylene glycol 6.23
    NMP 373.7
    cyclohexane 356.42
    DMSO 137.49
    n-butyl acetate 650.26
    n-octanol 211.52
    chloroform 945.94
    n-propyl acetate 261.84
    acetic acid 54.71
    dichloromethane 871.02
    cyclohexanone 713.9
    propylene glycol 17.1
    isopropyl acetate 282.26
    DMAc 280.07
    2-ethoxyethanol 98.35
    isopentanol 170.92
    n-heptane 320.74
    ethyl formate 135.23
    1,2-dichloroethane 501.38
    n-hexanol 312.82
    2-methoxyethanol 102.11
    isobutyl acetate 256.72
    tetrachloromethane 258.38
    n-pentyl acetate 387.85
    transcutol 496.32
    n-heptanol 191.75
    ethylbenzene 379.09
    MIBK 282.83
    2-propoxyethanol 248.09
    tert-butanol 172.64
    MTBE 390.68
    2-butoxyethanol 191.8
    propionic acid 79.52
    o-xylene 387.56
    formic acid 5.19
    diethyl ether 404.03
    m-xylene 434.0
    p-xylene 477.76
    chlorobenzene 531.88
    dimethyl carbonate 91.69
    n-octane 116.49
    formamide 13.67
    cyclopentanone 734.04
    2-pentanone 342.45
    anisole 414.01
    cyclopentyl methyl ether 583.6
    gamma-butyrolactone 495.42
    1-methoxy-2-propanol 126.41
    pyridine 738.63
    3-pentanone 310.51
    furfural 354.77
    n-dodecane 77.06
    diethylene glycol 78.69
    diisopropyl ether 205.28
    tert-amyl alcohol 178.32
    acetylacetone 340.08
    n-hexadecane 92.07
    acetophenone 356.25
    methyl propionate 208.68
    isopentyl acetate 607.66
    trichloroethylene 850.19
    n-nonanol 204.12
    cyclohexanol 256.74
    benzyl alcohol 204.82
    2-ethylhexanol 329.87
    isooctanol 185.41
    dipropyl ether 603.69
    1,2-dichlorobenzene 462.13
    ethyl lactate 83.21
    propylene carbonate 335.67
    n-methylformamide 62.28
    2-pentanol 140.28
    n-pentane 144.76
    1-propoxy-2-propanol 262.37
    1-methoxy-2-propyl acetate 411.06
    2-(2-methoxypropoxy) propanol 251.98
    mesitylene 310.03
    ε-caprolactone 531.02
    p-cymene 370.21
    epichlorohydrin 561.18
    1,1,1-trichloroethane 649.93
    2-aminoethanol 19.86
    morpholine-4-carbaldehyde 371.55
    sulfolane 446.71
    2,2,4-trimethylpentane 81.22
    2-methyltetrahydrofuran 863.09
    n-hexyl acetate 467.37
    isooctane 78.03
    2-(2-butoxyethoxy)ethanol 282.4
    sec-butyl acetate 240.6
    tert-butyl acetate 342.94
    decalin 175.35
    glycerin 20.75
    diglyme 514.36
    acrylic acid 54.32
    isopropyl myristate 271.66
    n-butyric acid 170.08
    acetyl acetate 221.87
    di(2-ethylhexyl) phthalate 202.83
    ethyl propionate 236.27
    nitromethane 111.94
    1,2-diethoxyethane 503.95
    benzonitrile 358.26
    trioctyl phosphate 157.9
    1-bromopropane 536.66
    gamma-valerolactone 586.57
    n-decanol 160.68
    triethyl phosphate 200.91
    4-methyl-2-pentanol 118.89
    propionitrile 200.06
    vinylene carbonate 279.8
    1,1,2-trichlorotrifluoroethane 195.29
    DMS 276.89
    cumene 266.46
    2-octanol 170.24
    2-hexanone 309.05
    octyl acetate 292.03
    limonene 472.28
    1,2-dimethoxyethane 367.58
    ethyl orthosilicate 213.02
    tributyl phosphate 181.12
    diacetone alcohol 215.82
    N,N-dimethylaniline 299.62
    acrylonitrile 165.42
    aniline 304.34
    1,3-propanediol 46.62
    bromobenzene 730.6
    dibromomethane 689.87
    1,1,2,2-tetrachloroethane 655.16
    2-methyl-cyclohexyl acetate 409.78
    tetrabutyl urea 240.95
    diisobutyl methanol 215.69
    2-phenylethanol 321.62
    styrene 421.48
    dioctyl adipate 312.18
    dimethyl sulfate 119.73
    ethyl butyrate 449.95
    methyl lactate 60.96
    butyl lactate 183.96
    diethyl carbonate 269.0
    propanediol butyl ether 131.33
    triethyl orthoformate 324.61
    p-tert-butyltoluene 351.24
    methyl 4-tert-butylbenzoate 339.27
    morpholine 576.53
    tert-butylamine 164.3
    n-dodecanol 136.02
    dimethoxymethane 228.43
    ethylene carbonate 253.1
    cyrene 216.36
    2-ethoxyethyl acetate 388.21
    2-ethylhexyl acetate 578.28
    1,2,4-trichlorobenzene 517.4
    4-methylpyridine 725.06
    dibutyl ether 462.43
    2,6-dimethyl-4-heptanol 215.69
    DEF 303.34
    dimethyl isosorbide 529.07
    tetrachloroethylene 395.89
    eugenol 242.6
    triacetin 310.02
    span 80 251.38
    1,4-butanediol 25.36
    1,1-dichloroethane 500.97
    2-methyl-1-pentanol 161.91
    methyl formate 57.4
    2-methyl-1-butanol 162.02
    n-decane 131.91
    butyronitrile 260.39
    3,7-dimethyl-1-octanol 224.72
    1-chlorooctane 309.39
    1-chlorotetradecane 144.87
    n-nonane 136.18
    undecane 96.99
    tert-butylcyclohexane 150.38
    cyclooctane 176.33
    cyclopentanol 233.41
    tetrahydropyran 948.56
    tert-amyl methyl ether 295.6
    2,5,8-trioxanonane 393.6
    1-hexene 370.08
    2-isopropoxyethanol 115.48
    2,2,2-trifluoroethanol 21.77
    methyl butyrate 286.04

    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
Eucalyptus globulus (China) 2 fruit 8016-26-0 Eucalyptus globulus Labill., fam. Myrtaceae 0.77%
Basil (Turkey) 2a 8015-73-4 Ocimum basilicum L., fam. Lamiaceae (Labiatae) 4.26%
Basil (Turkey) 2b 8015-73-4 Ocimum basilicum L., fam. Lamiaceae (Labiatae) 1.34%
Leptospermum javanicum (Malaysia) Leptospermum javanicum Blume, fam. Myrtaceae 0.25%
Lime (Mexican, West Indian, Key) 7 8008-26-2 Citrus aurantifolia (Christm.) Swingle, fam. Rutaceae 0.1%