Trisulfide, dibutyl

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  • Identifiers

    CAS number
    5943-31-7

    Molecular formula
    C8H18S3

    SMILES
    CCCCSSSCCCC

  • Odor profile

    Onion 77.34%
    Sulfurous 76.83%
    Garlic 69.01%
    Alliaceous 68.12%
    Green 53.95%
    Savory 52.48%
    Vegetable 47.14%
    Cooked 46.01%
    Roasted 42.6%
    Meaty 41.42%

    Scent© AI

  • Properties

    XLogP3-AA
    3.9

    Molecular weight
    210.4 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Slow

    Boiling point est.
    271°C

    Flash point est.
    133.26 ˚C

  • Synonyms

    • dibutyl trisulfide
    • TRISULFIDE, DIBUTYL
    • 5943-31-7
    • Butyl trisulfide
    • 1-butylsulfanyldisulfanyl-butane
    • Di-n-butyl trisulfide
    • 1,3-dibutyltrisulfane
    • DIBUTYLTRISULFANE
    • GJF8962XZZ
    • SCHEMBL17159695
    • DTXSID60499890
    • MFNTTYYYVNGQPW-UHFFFAOYSA-N
    • NS00123421

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 588.58
    methanol 292.17
    isopropanol 660.79
    water 0.01
    ethyl acetate 3624.49
    n-propanol 654.98
    acetone 5908.75
    n-butanol 824.52
    acetonitrile 1656.75
    DMF 4773.29
    toluene 4612.07
    isobutanol 649.34
    1,4-dioxane 6093.71
    methyl acetate 2447.12
    THF 11602.04
    2-butanone 3676.34
    n-pentanol 581.52
    sec-butanol 701.65
    n-hexane 805.18
    ethylene glycol 60.0
    NMP 5411.58
    cyclohexane 3471.44
    DMSO 4919.45
    n-butyl acetate 3913.57
    n-octanol 678.94
    chloroform 7362.66
    n-propyl acetate 2128.43
    acetic acid 922.21
    dichloromethane 6783.24
    cyclohexanone 9674.57
    propylene glycol 169.28
    isopropyl acetate 2414.65
    DMAc 3363.39
    2-ethoxyethanol 874.48
    isopentanol 914.13
    n-heptane 1259.93
    ethyl formate 1460.83
    1,2-dichloroethane 5591.46
    n-hexanol 1027.21
    2-methoxyethanol 1453.93
    isobutyl acetate 1377.41
    tetrachloromethane 1634.13
    n-pentyl acetate 2067.5
    transcutol 4128.28
    n-heptanol 527.21
    ethylbenzene 1482.57
    MIBK 2094.63
    2-propoxyethanol 1461.28
    tert-butanol 1206.91
    MTBE 2527.26
    2-butoxyethanol 906.8
    propionic acid 797.89
    o-xylene 1928.88
    formic acid 80.29
    diethyl ether 3032.57
    m-xylene 2197.0
    p-xylene 2011.72
    chlorobenzene 4288.05
    dimethyl carbonate 985.34
    n-octane 407.53
    formamide 234.31
    cyclopentanone 9964.02
    2-pentanone 3971.64
    anisole 2258.7
    cyclopentyl methyl ether 6018.55
    gamma-butyrolactone 6640.74
    1-methoxy-2-propanol 1292.06
    pyridine 7400.83
    3-pentanone 3190.72
    furfural 5377.17
    n-dodecane 196.75
    diethylene glycol 579.77
    diisopropyl ether 1279.88
    tert-amyl alcohol 999.05
    acetylacetone 4927.53
    n-hexadecane 248.75
    acetophenone 2223.36
    methyl propionate 2385.25
    isopentyl acetate 2940.24
    trichloroethylene 9977.64
    n-nonanol 628.11
    cyclohexanol 2057.77
    benzyl alcohol 1093.11
    2-ethylhexanol 1102.63
    isooctanol 507.15
    dipropyl ether 3238.7
    1,2-dichlorobenzene 3415.1
    ethyl lactate 534.0
    propylene carbonate 3441.61
    n-methylformamide 1079.94
    2-pentanol 768.44
    n-pentane 645.96
    1-propoxy-2-propanol 1649.6
    1-methoxy-2-propyl acetate 2659.68
    2-(2-methoxypropoxy) propanol 967.6
    mesitylene 1415.41
    ε-caprolactone 5185.83
    p-cymene 1103.07
    epichlorohydrin 6901.72
    1,1,1-trichloroethane 6475.53
    2-aminoethanol 185.34
    morpholine-4-carbaldehyde 4756.4
    sulfolane 8269.01
    2,2,4-trimethylpentane 281.93
    2-methyltetrahydrofuran 7140.36
    n-hexyl acetate 2310.5
    isooctane 272.33
    2-(2-butoxyethoxy)ethanol 1387.34
    sec-butyl acetate 1516.47
    tert-butyl acetate 2819.38
    decalin 776.28
    glycerin 232.15
    diglyme 3539.86
    acrylic acid 641.91
    isopropyl myristate 1010.23
    n-butyric acid 1821.38
    acetyl acetate 2311.33
    di(2-ethylhexyl) phthalate 620.96
    ethyl propionate 1852.24
    nitromethane 2671.73
    1,2-diethoxyethane 3691.43
    benzonitrile 2677.94
    trioctyl phosphate 492.21
    1-bromopropane 3624.67
    gamma-valerolactone 8734.42
    n-decanol 454.49
    triethyl phosphate 974.12
    4-methyl-2-pentanol 519.36
    propionitrile 1495.92
    vinylene carbonate 2830.71
    1,1,2-trichlorotrifluoroethane 3020.12
    DMS 1548.24
    cumene 771.72
    2-octanol 494.51
    2-hexanone 2246.88
    octyl acetate 1116.13
    limonene 2200.86
    1,2-dimethoxyethane 3594.64
    ethyl orthosilicate 1021.56
    tributyl phosphate 734.35
    diacetone alcohol 1836.55
    N,N-dimethylaniline 1413.25
    acrylonitrile 1741.13
    aniline 2332.85
    1,3-propanediol 422.2
    bromobenzene 5912.47
    dibromomethane 5203.41
    1,1,2,2-tetrachloroethane 8030.51
    2-methyl-cyclohexyl acetate 1812.79
    tetrabutyl urea 1055.97
    diisobutyl methanol 924.49
    2-phenylethanol 1255.72
    styrene 2220.63
    dioctyl adipate 1306.96
    dimethyl sulfate 1603.4
    ethyl butyrate 2636.73
    methyl lactate 635.18
    butyl lactate 1029.9
    diethyl carbonate 1465.04
    propanediol butyl ether 723.01
    triethyl orthoformate 1954.47
    p-tert-butyltoluene 1129.28
    methyl 4-tert-butylbenzoate 1363.7
    morpholine 5860.66
    tert-butylamine 948.16
    n-dodecanol 376.7
    dimethoxymethane 2994.19
    ethylene carbonate 2615.91
    cyrene 1123.7
    2-ethoxyethyl acetate 2408.9
    2-ethylhexyl acetate 2669.4
    1,2,4-trichlorobenzene 3516.19
    4-methylpyridine 6898.77
    dibutyl ether 2621.68
    2,6-dimethyl-4-heptanol 924.49
    DEF 3905.98
    dimethyl isosorbide 2590.99
    tetrachloroethylene 4624.72
    eugenol 1003.7
    triacetin 1879.69
    span 80 1097.28
    1,4-butanediol 177.78
    1,1-dichloroethane 4960.8
    2-methyl-1-pentanol 600.06
    methyl formate 1112.78
    2-methyl-1-butanol 746.62
    n-decane 410.51
    butyronitrile 2017.83
    3,7-dimethyl-1-octanol 853.79
    1-chlorooctane 1227.56
    1-chlorotetradecane 461.83
    n-nonane 469.44
    undecane 263.31
    tert-butylcyclohexane 536.78
    cyclooctane 1208.27
    cyclopentanol 1905.27
    tetrahydropyran 8262.28
    tert-amyl methyl ether 1884.77
    2,5,8-trioxanonane 2006.93
    1-hexene 1618.8
    2-isopropoxyethanol 722.13
    2,2,2-trifluoroethanol 308.36
    methyl butyrate 2581.77

    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