Benzyl hexyl ether

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  • Identifiers

    CAS number
    61103-84-2

    Molecular formula
    C13H20O

    SMILES
    CCCCCCOCC1=CC=CC=C1

    Safety labels

    Environmental Hazard
    Environmental

  • Odor profile

    Fruity 85.05%
    Green 79.82%
    Floral 71.8%
    Sweet 55.73%
    Herbal 51.72%
    Balsamic 38.11%
    Earthy 37.52%
    Rose 36.74%
    Jasmin 35.17%
    Fresh 32.66%

    Scent© AI

  • Properties

    XLogP3-AA
    3.9

    Molecular weight
    192.3 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Slow

    Boiling point est.
    262°C

    Flash point est.
    105.18 ˚C

  • Synonyms

    • BENZYL HEXYL ETHER
    • Benzene, [(hexyloxy)methyl]-
    • 61103-84-2
    • SCHEMBL2886385
    • DTXSID10393915
    • AKOS024323957
    • 667-099-6

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 4830.55
    methanol 2941.46
    isopropanol 3582.19
    water 0.09
    ethyl acetate 9009.92
    n-propanol 4069.93
    acetone 6267.1
    n-butanol 4430.24
    acetonitrile 5439.89
    DMF 1764.02
    toluene 2138.85
    isobutanol 2927.15
    1,4-dioxane 7525.88
    methyl acetate 4430.53
    THF 6315.6
    2-butanone 4836.77
    n-pentanol 2807.41
    sec-butanol 3149.46
    n-hexane 1953.22
    ethylene glycol 250.82
    NMP 955.13
    cyclohexane 3216.99
    DMSO 3756.89
    n-butyl acetate 7167.79
    n-octanol 916.98
    chloroform 11328.28
    n-propyl acetate 4629.09
    acetic acid 2611.54
    dichloromethane 13202.35
    cyclohexanone 5663.49
    propylene glycol 462.98
    isopropyl acetate 4079.94
    DMAc 1320.8
    2-ethoxyethanol 2642.37
    isopentanol 3656.11
    n-heptane 1431.38
    ethyl formate 2887.78
    1,2-dichloroethane 10284.82
    n-hexanol 3705.33
    2-methoxyethanol 3471.21
    isobutyl acetate 2377.89
    tetrachloromethane 1793.41
    n-pentyl acetate 2066.15
    transcutol 8930.62
    n-heptanol 986.92
    ethylbenzene 1202.45
    MIBK 2482.84
    2-propoxyethanol 3525.62
    tert-butanol 4006.22
    MTBE 5514.57
    2-butoxyethanol 1544.92
    propionic acid 1890.75
    o-xylene 976.59
    formic acid 298.72
    diethyl ether 10881.64
    m-xylene 1144.87
    p-xylene 1333.94
    chlorobenzene 2736.28
    dimethyl carbonate 807.78
    n-octane 358.74
    formamide 546.99
    cyclopentanone 3278.57
    2-pentanone 5151.28
    anisole 1970.71
    cyclopentyl methyl ether 3831.55
    gamma-butyrolactone 3091.76
    1-methoxy-2-propanol 2580.21
    pyridine 5079.12
    3-pentanone 3311.34
    furfural 2536.75
    n-dodecane 171.45
    diethylene glycol 1386.5
    diisopropyl ether 2389.32
    tert-amyl alcohol 2677.05
    acetylacetone 3518.06
    n-hexadecane 202.02
    acetophenone 1538.75
    methyl propionate 3494.05
    isopentyl acetate 4539.7
    trichloroethylene 11732.65
    n-nonanol 803.49
    cyclohexanol 3128.81
    benzyl alcohol 1170.49
    2-ethylhexanol 2488.96
    isooctanol 850.36
    dipropyl ether 6113.27
    1,2-dichlorobenzene 2174.02
    ethyl lactate 819.61
    propylene carbonate 2312.87
    n-methylformamide 1078.28
    2-pentanol 3224.61
    n-pentane 1554.4
    1-propoxy-2-propanol 3121.62
    1-methoxy-2-propyl acetate 2918.4
    2-(2-methoxypropoxy) propanol 1103.48
    mesitylene 745.07
    ε-caprolactone 4228.06
    p-cymene 803.77
    epichlorohydrin 6107.96
    1,1,1-trichloroethane 7314.97
    2-aminoethanol 801.46
    morpholine-4-carbaldehyde 2038.72
    sulfolane 2651.28
    2,2,4-trimethylpentane 380.08
    2-methyltetrahydrofuran 5691.92
    n-hexyl acetate 2280.95
    isooctane 363.03
    2-(2-butoxyethoxy)ethanol 1815.45
    sec-butyl acetate 2657.3
    tert-butyl acetate 3071.08
    decalin 693.46
    glycerin 463.66
    diglyme 4178.23
    acrylic acid 1093.95
    isopropyl myristate 867.85
    n-butyric acid 4830.32
    acetyl acetate 3278.38
    di(2-ethylhexyl) phthalate 471.98
    ethyl propionate 3272.7
    nitromethane 4033.26
    1,2-diethoxyethane 6391.79
    benzonitrile 1930.95
    trioctyl phosphate 400.29
    1-bromopropane 7737.13
    gamma-valerolactone 3988.56
    n-decanol 565.76
    triethyl phosphate 884.37
    4-methyl-2-pentanol 1401.79
    propionitrile 3911.36
    vinylene carbonate 1951.04
    1,1,2-trichlorotrifluoroethane 2619.05
    DMS 1377.98
    cumene 718.0
    2-octanol 645.72
    2-hexanone 3751.63
    octyl acetate 934.9
    limonene 1515.0
    1,2-dimethoxyethane 5652.02
    ethyl orthosilicate 1006.62
    tributyl phosphate 619.03
    diacetone alcohol 1901.23
    N,N-dimethylaniline 975.35
    acrylonitrile 2987.21
    aniline 1812.55
    1,3-propanediol 1615.34
    bromobenzene 3311.63
    dibromomethane 9860.23
    1,1,2,2-tetrachloroethane 9021.36
    2-methyl-cyclohexyl acetate 1602.68
    tetrabutyl urea 736.81
    diisobutyl methanol 1311.1
    2-phenylethanol 1417.24
    styrene 1777.88
    dioctyl adipate 1035.83
    dimethyl sulfate 806.6
    ethyl butyrate 4555.28
    methyl lactate 688.48
    butyl lactate 1022.01
    diethyl carbonate 2237.37
    propanediol butyl ether 894.3
    triethyl orthoformate 2204.91
    p-tert-butyltoluene 722.73
    methyl 4-tert-butylbenzoate 852.98
    morpholine 7648.37
    tert-butylamine 3201.63
    n-dodecanol 447.32
    dimethoxymethane 2792.68
    ethylene carbonate 2185.32
    cyrene 623.53
    2-ethoxyethyl acetate 2402.01
    2-ethylhexyl acetate 3393.83
    1,2,4-trichlorobenzene 2137.79
    4-methylpyridine 4213.99
    dibutyl ether 3724.51
    2,6-dimethyl-4-heptanol 1311.1
    DEF 3592.35
    dimethyl isosorbide 1665.19
    tetrachloroethylene 5719.05
    eugenol 796.12
    triacetin 1438.25
    span 80 1011.88
    1,4-butanediol 604.98
    1,1-dichloroethane 9499.86
    2-methyl-1-pentanol 2324.94
    methyl formate 882.35
    2-methyl-1-butanol 2946.19
    n-decane 354.84
    butyronitrile 5613.81
    3,7-dimethyl-1-octanol 1102.34
    1-chlorooctane 1184.07
    1-chlorotetradecane 376.8
    n-nonane 421.61
    undecane 230.74
    tert-butylcyclohexane 582.17
    cyclooctane 806.73
    cyclopentanol 1862.2
    tetrahydropyran 10695.46
    tert-amyl methyl ether 2817.47
    2,5,8-trioxanonane 2102.05
    1-hexene 4942.68
    2-isopropoxyethanol 1901.59
    2,2,2-trifluoroethanol 491.59
    methyl butyrate 4642.95

    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