2,4,6-Trimethylnonan-4-ol

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  • Identifiers

    CAS number
    84110-44-1

    Molecular formula
    C12H26O

    SMILES
    CCCC(C)CC(C)(CC(C)C)O

    Safety labels

  • Odor profile

    Fragrance
    Floral 79.61%
    Fruity 54.24%
    Citrus 52.98%
    Rose 51.85%
    Fresh 48.82%
    Sweet 43.98%
    Woody 43.74%
    Herbal 42.59%
    Lily 39.33%
    Lemon 37.07%

     

    Flavor
    Floral 46.12%
    Green 45.34%
    Mild 37.33%
    Lily 36.42%
    Fresh 35.14%
    Waxy 32.57%
    Woody 32.14%
    Oily 31.43%
    Citrus 29.41%
    Flower 26.23%

     

    Odor impact est.
    Medium

  • Properties

    XLogP3-AA
    4.3

    pKa est.
    9.47 (weak base)

    Molecular weight
    186.33 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Moderate

    Boiling point est.
    217°C

    Flash point

    • 92.5 ˚C est.

  • Synonyms

    • 2,4,6-Trimethylnonan-4-ol
    • 84110-44-1
    • EINECS 282-179-7
    • SCHEMBL233149
    • RTGWCORQKNEYIB-UHFFFAOYSA-N
    • DTXSID301004391
    • NS00058078
    • 84110-44-1

  • Applications

    2,4,6-Trimethylnonan-4-ol is commonly used as a fragrance ingredient and fixative in perfumery, where its branched, long-chain structure helps retain and stabilize aroma notes; in cosmetics and personal care it may serve as a fragrance component and solvent or carrier in formulations; in household products it contributes to fragrance and can function as a solvent or formulation aid; in industrial manufacturing it is used as a processing solvent and a chemical intermediate; in polymers and plastics it may act as an intermediate or processing aid during synthesis or formulation; in coatings and inks it can serve as a solvent or coalescing aid to modify drying characteristics; and in cleaning formulations it is used as a solvent or fragrance carrier, subject to local regulations and formulation limits.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 9269.95
    methanol 9943.39
    isopropanol 8945.93
    water 1.31
    ethyl acetate 4054.76
    n-propanol 7409.64
    acetone 5143.01
    n-butanol 8064.38
    acetonitrile 3289.42
    DMF 3359.03
    toluene 2120.48
    isobutanol 6427.13
    1,4-dioxane 8106.42
    methyl acetate 2868.12
    THF 14874.81
    2-butanone 3969.95
    n-pentanol 5276.49
    sec-butanol 7126.05
    n-hexane 6085.71
    ethylene glycol 615.45
    NMP 2975.12
    cyclohexane 6892.84
    DMSO 2538.18
    n-butyl acetate 7290.24
    n-octanol 4004.87
    chloroform 6139.57
    n-propyl acetate 2846.92
    acetic acid 3120.1
    dichloromethane 4008.93
    cyclohexanone 7130.65
    propylene glycol 1442.19
    isopropyl acetate 3324.74
    DMAc 2079.45
    2-ethoxyethanol 2640.7
    isopentanol 7009.4
    n-heptane 6247.93
    ethyl formate 2405.47
    1,2-dichloroethane 2930.9
    n-hexanol 13986.86
    2-methoxyethanol 4918.95
    isobutyl acetate 2245.1
    tetrachloromethane 1580.62
    n-pentyl acetate 3078.11
    transcutol 6312.19
    n-heptanol 4177.37
    ethylbenzene 1308.93
    MIBK 3080.06
    2-propoxyethanol 7643.75
    tert-butanol 10264.03
    MTBE 9803.73
    2-butoxyethanol 3215.1
    propionic acid 2635.97
    o-xylene 1284.84
    formic acid 698.89
    diethyl ether 8585.95
    m-xylene 1604.79
    p-xylene 1846.58
    chlorobenzene 1967.17
    dimethyl carbonate 559.68
    n-octane 1434.78
    formamide 554.05
    cyclopentanone 5420.4
    2-pentanone 4622.8
    anisole 1415.54
    cyclopentyl methyl ether 7159.92
    gamma-butyrolactone 4449.32
    1-methoxy-2-propanol 4167.43
    pyridine 3383.64
    3-pentanone 2706.0
    furfural 2436.49
    n-dodecane 689.0
    diethylene glycol 2454.53
    diisopropyl ether 3510.97
    tert-amyl alcohol 7560.88
    acetylacetone 2438.52
    n-hexadecane 770.95
    acetophenone 1086.62
    methyl propionate 2333.41
    isopentyl acetate 5981.25
    trichloroethylene 3927.17
    n-nonanol 3077.74
    cyclohexanol 7526.59
    benzyl alcohol 1171.55
    2-ethylhexanol 7362.8
    isooctanol 3063.84
    dipropyl ether 8299.83
    1,2-dichlorobenzene 1225.63
    ethyl lactate 821.35
    propylene carbonate 2725.98
    n-methylformamide 1859.22
    2-pentanol 6046.36
    n-pentane 4374.7
    1-propoxy-2-propanol 6811.54
    1-methoxy-2-propyl acetate 3392.09
    2-(2-methoxypropoxy) propanol 1680.93
    mesitylene 1270.34
    ε-caprolactone 5392.21
    p-cymene 1527.59
    epichlorohydrin 4352.88
    1,1,1-trichloroethane 3306.48
    2-aminoethanol 1877.85
    morpholine-4-carbaldehyde 3329.46
    sulfolane 3401.68
    2,2,4-trimethylpentane 1464.85
    2-methyltetrahydrofuran 10548.55
    n-hexyl acetate 4634.65
    isooctane 1558.62
    2-(2-butoxyethoxy)ethanol 2833.28
    sec-butyl acetate 2119.51
    tert-butyl acetate 3519.18
    decalin 1686.73
    glycerin 1183.93
    diglyme 4339.21
    acrylic acid 1306.95
    isopropyl myristate 1555.08
    n-butyric acid 5649.05
    acetyl acetate 1513.13
    di(2-ethylhexyl) phthalate 935.32
    ethyl propionate 2042.34
    nitromethane 2512.34
    1,2-diethoxyethane 4216.07
    benzonitrile 1792.67
    trioctyl phosphate 981.27
    1-bromopropane 4571.16
    gamma-valerolactone 5759.6
    n-decanol 2088.57
    triethyl phosphate 861.13
    4-methyl-2-pentanol 3585.51
    propionitrile 3431.97
    vinylene carbonate 1848.49
    1,1,2-trichlorotrifluoroethane 2349.96
    DMS 1209.83
    cumene 1017.88
    2-octanol 3092.54
    2-hexanone 3743.18
    octyl acetate 1900.05
    limonene 3507.91
    1,2-dimethoxyethane 5704.85
    ethyl orthosilicate 1071.61
    tributyl phosphate 1143.82
    diacetone alcohol 2922.26
    N,N-dimethylaniline 1056.29
    acrylonitrile 2167.53
    aniline 1925.81
    1,3-propanediol 3176.2
    bromobenzene 1974.02
    dibromomethane 4089.2
    1,1,2,2-tetrachloroethane 3564.34
    2-methyl-cyclohexyl acetate 2463.36
    tetrabutyl urea 1348.92
    diisobutyl methanol 3207.16
    2-phenylethanol 2302.4
    styrene 1301.56
    dioctyl adipate 1443.87
    dimethyl sulfate 603.16
    ethyl butyrate 3263.95
    methyl lactate 851.16
    butyl lactate 1846.21
    diethyl carbonate 1415.03
    propanediol butyl ether 2731.27
    triethyl orthoformate 2323.49
    p-tert-butyltoluene 1524.95
    methyl 4-tert-butylbenzoate 1312.86
    morpholine 9739.98
    tert-butylamine 8823.8
    n-dodecanol 1504.46
    dimethoxymethane 3194.46
    ethylene carbonate 2107.22
    cyrene 1081.01
    2-ethoxyethyl acetate 2142.7
    2-ethylhexyl acetate 4974.36
    1,2,4-trichlorobenzene 1326.15
    4-methylpyridine 3788.1
    dibutyl ether 5336.38
    2,6-dimethyl-4-heptanol 3207.16
    DEF 3383.24
    dimethyl isosorbide 2589.81
    tetrachloroethylene 2528.28
    eugenol 1060.15
    triacetin 1636.22
    span 80 2170.79
    1,4-butanediol 1089.07
    1,1-dichloroethane 3999.12
    2-methyl-1-pentanol 4216.18
    methyl formate 1232.74
    2-methyl-1-butanol 5948.21
    n-decane 1428.51
    butyronitrile 5854.5
    3,7-dimethyl-1-octanol 3521.33
    1-chlorooctane 2752.36
    1-chlorotetradecane 911.89
    n-nonane 1722.61
    undecane 938.98
    tert-butylcyclohexane 1868.08
    cyclooctane 2284.77
    cyclopentanol 6043.39
    tetrahydropyran 13537.92
    tert-amyl methyl ether 5617.21
    2,5,8-trioxanonane 2231.31
    1-hexene 7755.14
    2-isopropoxyethanol 2122.13
    2,2,2-trifluoroethanol 528.06
    methyl butyrate 2843.03

    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