3-Octen-1-OL

Overview IFRA Botanical Request a quote

  • Identifiers

    CAS number
    18185-81-4

    Molecular formula
    C8H16O

    SMILES
    CCCC/C=C/CCO

    Retention indicies (RI)

    • DB5: 978.0
    • Carbowax: 1541.0

  • Odor profile

    Green 93.03%
    Fatty 76.11%
    Fresh 67.5%
    Melon 64.06%
    Waxy 63.1%
    Vegetable 62.65%
    Herbal 61.72%
    Earthy 61.71%
    Cucumber 58.45%
    Fruity 57.93%

    Scent© AI

  • Properties

    XLogP3-AA
    2.4

    pKa est.
    8.57 (weak base)

    Molecular weight
    128.21 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Moderate

    Boiling point est.
    196°C

    Flash point est.
    83.53 ˚C

  • Synonyms

    • oct-3-en-1-ol
    • 3-Octen-1-ol, (3E)-
    • (E)-Oct-3-en-1-ol
    • 20125-85-3
    • (E)-3-Octen-1-ol
    • trans-3-Octen-1-Ol
    • 3-OCTEN-1-OL
    • (3E)-oct-3-en-1-ol
    • 18185-81-4
    • (3E)-3-Octen-1-ol
    • 3-Octen-1-ol, (E)-
    • EINECS 242-071-2
    • EINECS 243-534-1
    • trans-oct-3-en-1-ol
    • AI3-07194
    • SCHEMBL473592
    • SCHEMBL1129182
    • DTXSID40885116
    • CHEBI:168692
    • LMFA05000560
    • NS00083991
    • D91844

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 16676.87
    methanol 13934.41
    isopropanol 15243.16
    water 0.68
    ethyl acetate 5329.65
    n-propanol 13257.14
    acetone 10703.89
    n-butanol 12453.55
    acetonitrile 4430.66
    DMF 5593.9
    toluene 1274.63
    isobutanol 8693.76
    1,4-dioxane 6573.47
    methyl acetate 3671.67
    THF 11739.02
    2-butanone 5885.56
    n-pentanol 5903.98
    sec-butanol 9185.82
    n-hexane 2190.42
    ethylene glycol 1517.28
    NMP 2309.73
    cyclohexane 2272.04
    DMSO 10628.86
    n-butyl acetate 4481.92
    n-octanol 1381.89
    chloroform 4873.41
    n-propyl acetate 3112.58
    acetic acid 4714.32
    dichloromethane 4749.61
    cyclohexanone 5840.81
    propylene glycol 2722.79
    isopropyl acetate 2525.68
    DMAc 1808.47
    2-ethoxyethanol 4004.82
    isopentanol 7638.28
    n-heptane 1459.8
    ethyl formate 2433.82
    1,2-dichloroethane 3880.87
    n-hexanol 6902.4
    2-methoxyethanol 8506.31
    isobutyl acetate 1419.72
    tetrachloromethane 1372.78
    n-pentyl acetate 1468.13
    transcutol 7629.05
    n-heptanol 1757.11
    ethylbenzene 547.46
    MIBK 2326.41
    2-propoxyethanol 5789.68
    tert-butanol 12388.85
    MTBE 6426.26
    2-butoxyethanol 2214.96
    propionic acid 4377.08
    o-xylene 550.32
    formic acid 900.95
    diethyl ether 7761.62
    m-xylene 807.93
    p-xylene 618.03
    chlorobenzene 1244.36
    dimethyl carbonate 551.78
    n-octane 302.18
    formamide 1437.09
    cyclopentanone 5906.28
    2-pentanone 6041.86
    anisole 978.37
    cyclopentyl methyl ether 5421.45
    gamma-butyrolactone 4750.86
    1-methoxy-2-propanol 6287.07
    pyridine 3944.01
    3-pentanone 2751.18
    furfural 2274.14
    n-dodecane 123.51
    diethylene glycol 2672.84
    diisopropyl ether 1788.38
    tert-amyl alcohol 6399.9
    acetylacetone 2843.72
    n-hexadecane 135.63
    acetophenone 704.2
    methyl propionate 3065.11
    isopentyl acetate 2818.95
    trichloroethylene 4723.97
    n-nonanol 1060.02
    cyclohexanol 6431.9
    benzyl alcohol 1042.81
    2-ethylhexanol 2978.42
    isooctanol 1214.85
    dipropyl ether 4851.83
    1,2-dichlorobenzene 794.43
    ethyl lactate 683.88
    propylene carbonate 1852.69
    n-methylformamide 3637.47
    2-pentanol 7575.83
    n-pentane 2082.4
    1-propoxy-2-propanol 4501.75
    1-methoxy-2-propyl acetate 2016.12
    2-(2-methoxypropoxy) propanol 913.62
    mesitylene 455.52
    ε-caprolactone 3598.67
    p-cymene 467.56
    epichlorohydrin 5217.58
    1,1,1-trichloroethane 3292.21
    2-aminoethanol 4263.81
    morpholine-4-carbaldehyde 2592.52
    sulfolane 4055.64
    2,2,4-trimethylpentane 445.31
    2-methyltetrahydrofuran 9045.01
    n-hexyl acetate 1719.67
    isooctane 439.74
    2-(2-butoxyethoxy)ethanol 1780.48
    sec-butyl acetate 1484.74
    tert-butyl acetate 2131.71
    decalin 427.84
    glycerin 1884.11
    diglyme 3368.21
    acrylic acid 2207.8
    isopropyl myristate 489.0
    n-butyric acid 7806.42
    acetyl acetate 1306.18
    di(2-ethylhexyl) phthalate 327.84
    ethyl propionate 1945.79
    nitromethane 4578.8
    1,2-diethoxyethane 3699.01
    benzonitrile 1248.38
    trioctyl phosphate 333.31
    1-bromopropane 4256.84
    gamma-valerolactone 4864.98
    n-decanol 714.73
    triethyl phosphate 458.44
    4-methyl-2-pentanol 2393.75
    propionitrile 4654.0
    vinylene carbonate 1365.57
    1,1,2-trichlorotrifluoroethane 2711.52
    DMS 636.66
    cumene 327.07
    2-octanol 1051.45
    2-hexanone 3273.93
    octyl acetate 624.15
    limonene 1125.66
    1,2-dimethoxyethane 5790.34
    ethyl orthosilicate 555.61
    tributyl phosphate 421.44
    diacetone alcohol 2375.64
    N,N-dimethylaniline 512.37
    acrylonitrile 3529.33
    aniline 2003.84
    1,3-propanediol 5781.24
    bromobenzene 1202.93
    dibromomethane 4138.37
    1,1,2,2-tetrachloroethane 3888.43
    2-methyl-cyclohexyl acetate 991.83
    tetrabutyl urea 518.12
    diisobutyl methanol 1334.49
    2-phenylethanol 1274.72
    styrene 789.2
    dioctyl adipate 591.52
    dimethyl sulfate 664.69
    ethyl butyrate 2463.52
    methyl lactate 941.07
    butyl lactate 916.33
    diethyl carbonate 942.78
    propanediol butyl ether 1629.51
    triethyl orthoformate 1250.11
    p-tert-butyltoluene 458.91
    methyl 4-tert-butylbenzoate 530.58
    morpholine 9681.95
    tert-butylamine 8879.07
    n-dodecanol 516.05
    dimethoxymethane 3974.89
    ethylene carbonate 1454.29
    cyrene 614.79
    2-ethoxyethyl acetate 1425.33
    2-ethylhexyl acetate 2006.31
    1,2,4-trichlorobenzene 795.83
    4-methylpyridine 3311.15
    dibutyl ether 2520.57
    2,6-dimethyl-4-heptanol 1334.49
    DEF 3933.63
    dimethyl isosorbide 1235.29
    tetrachloroethylene 3021.3
    eugenol 577.49
    triacetin 777.61
    span 80 1125.14
    1,4-butanediol 1759.9
    1,1-dichloroethane 4961.14
    2-methyl-1-pentanol 3190.86
    methyl formate 1880.93
    2-methyl-1-butanol 6417.91
    n-decane 262.2
    butyronitrile 6416.28
    3,7-dimethyl-1-octanol 1259.41
    1-chlorooctane 809.79
    1-chlorotetradecane 239.91
    n-nonane 330.98
    undecane 167.87
    tert-butylcyclohexane 434.21
    cyclooctane 587.48
    cyclopentanol 6945.13
    tetrahydropyran 11682.98
    tert-amyl methyl ether 3084.36
    2,5,8-trioxanonane 1546.43
    1-hexene 4960.37
    2-isopropoxyethanol 2395.6
    2,2,2-trifluoroethanol 655.14
    methyl butyrate 3077.6

    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
Lavandin (Italy) 1 (Grosso) 8022-15-9 Lavandula x hybrida Rev. (L. x intermedia Emeric ex Loiseleur), Lamiaceae 0.01%
Fokienia hodginsii Fokienia hodginsii (Dunn) Henry et Thomas, fam. Cupressaceae 0.28%
Genet headspace 2 8023-80-1 Spartium junceum L., fam. Leguminosae (Papilionaceae) 30.0%
Salvia syriaca (Turkey) Salvia syriaca L., fam. Lamiaceae (Labiatea) 0.59%
Bay, West Indian (Guadeloupe) 1a 8015-73-4 Pimenta racemosa var. racemosa (P. Miller) J.W. Moore, fam. Myrtaceae 2.0%
Rosemary (Cuba) 8000-27-5 Rosmarinus officinalis L., fam. Lamiaceae (Labiatae) 0.36%