Propyl 1-propenyl tetrasulfide

Overview IFRA Botanical Request a quote

  • Identifiers

    Molecular formula
    C6H12S4

    SMILES
    CCCSSSS/C=C/C

  • Odor profile

    Onion 85.28%
    Garlic 78.94%
    Sulfurous 78.05%
    Alliaceous 63.48%
    Savory 54.0%
    Roasted 51.81%
    Cooked 51.77%
    Pungent 48.94%
    Meaty 33.6%
    Cabbage 28.71%

    Scent© AI

  • Properties

    XLogP3-AA
    3.4

    Molecular weight
    212.4 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Very slow

    Boiling point est.
    293°C

    Flash point est.
    139.12 ˚C

  • Synonyms

    • propyl 1-propenyl tetrasulfide
    • Propyl 1-propenyl tetrasulfide, (E)-
    • SCHEMBL6658853
    • RKTJCWCBNXCDDQ-HWKANZROSA-N
    • RKTJCWCBNXCDDQ-UHFFFAOYSA-N
    • Propyl (E)-1-propenyl tetrasulfide

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 591.06
    methanol 406.64
    isopropanol 538.95
    water 0.06
    ethyl acetate 2118.85
    n-propanol 550.23
    acetone 4502.08
    n-butanol 657.28
    acetonitrile 1497.42
    DMF 7298.73
    toluene 3440.64
    isobutanol 487.69
    1,4-dioxane 4890.8
    methyl acetate 1905.74
    THF 7768.67
    2-butanone 2718.56
    n-pentanol 486.05
    sec-butanol 553.69
    n-hexane 262.4
    ethylene glycol 121.73
    NMP 6501.32
    cyclohexane 1085.26
    DMSO 5713.08
    n-butyl acetate 2016.38
    n-octanol 433.35
    chloroform 4102.02
    n-propyl acetate 1296.13
    acetic acid 948.69
    dichloromethane 4221.16
    cyclohexanone 6279.97
    propylene glycol 250.52
    isopropyl acetate 1321.72
    DMAc 4451.14
    2-ethoxyethanol 943.18
    isopentanol 626.29
    n-heptane 325.16
    ethyl formate 1123.38
    1,2-dichloroethane 3440.93
    n-hexanol 642.43
    2-methoxyethanol 1698.89
    isobutyl acetate 870.15
    tetrachloromethane 700.29
    n-pentyl acetate 1123.27
    transcutol 3852.36
    n-heptanol 318.58
    ethylbenzene 1013.2
    MIBK 1414.39
    2-propoxyethanol 1258.69
    tert-butanol 801.33
    MTBE 1696.36
    2-butoxyethanol 694.07
    propionic acid 592.86
    o-xylene 1324.31
    formic acid 139.84
    diethyl ether 1648.12
    m-xylene 1615.23
    p-xylene 1239.07
    chlorobenzene 3264.09
    dimethyl carbonate 994.85
    n-octane 137.42
    formamide 400.02
    cyclopentanone 7166.51
    2-pentanone 2573.61
    anisole 2051.5
    cyclopentyl methyl ether 3796.66
    gamma-butyrolactone 5006.01
    1-methoxy-2-propanol 1274.19
    pyridine 6143.61
    3-pentanone 2032.46
    furfural 5016.68
    n-dodecane 107.57
    diethylene glycol 724.84
    diisopropyl ether 631.76
    tert-amyl alcohol 750.5
    acetylacetone 4007.0
    n-hexadecane 132.56
    acetophenone 1955.58
    methyl propionate 1808.99
    isopentyl acetate 1711.36
    trichloroethylene 7418.27
    n-nonanol 399.63
    cyclohexanol 1349.06
    benzyl alcohol 1139.48
    2-ethylhexanol 628.56
    isooctanol 290.46
    dipropyl ether 1265.32
    1,2-dichlorobenzene 2365.71
    ethyl lactate 415.76
    propylene carbonate 2369.71
    n-methylformamide 1472.81
    2-pentanol 534.47
    n-pentane 266.7
    1-propoxy-2-propanol 1201.05
    1-methoxy-2-propyl acetate 1997.96
    2-(2-methoxypropoxy) propanol 970.35
    mesitylene 923.74
    ε-caprolactone 3352.81
    p-cymene 618.1
    epichlorohydrin 5325.55
    1,1,1-trichloroethane 3247.41
    2-aminoethanol 264.41
    morpholine-4-carbaldehyde 5957.74
    sulfolane 6528.21
    2,2,4-trimethylpentane 151.79
    2-methyltetrahydrofuran 4544.68
    n-hexyl acetate 1392.45
    isooctane 154.97
    2-(2-butoxyethoxy)ethanol 1295.53
    sec-butyl acetate 891.68
    tert-butyl acetate 1803.19
    decalin 385.76
    glycerin 357.5
    diglyme 3022.41
    acrylic acid 618.17
    isopropyl myristate 649.43
    n-butyric acid 1103.98
    acetyl acetate 1576.07
    di(2-ethylhexyl) phthalate 548.39
    ethyl propionate 1043.46
    nitromethane 3180.67
    1,2-diethoxyethane 2394.33
    benzonitrile 2449.07
    trioctyl phosphate 378.01
    1-bromopropane 1728.89
    gamma-valerolactone 8137.72
    n-decanol 318.39
    triethyl phosphate 587.8
    4-methyl-2-pentanol 347.0
    propionitrile 1020.56
    vinylene carbonate 2175.97
    1,1,2-trichlorotrifluoroethane 2759.43
    DMS 1437.09
    cumene 511.86
    2-octanol 291.13
    2-hexanone 1547.88
    octyl acetate 742.13
    limonene 1134.13
    1,2-dimethoxyethane 3204.68
    ethyl orthosilicate 614.59
    tributyl phosphate 539.46
    diacetone alcohol 1511.13
    N,N-dimethylaniline 1321.55
    acrylonitrile 1462.43
    aniline 2090.06
    1,3-propanediol 486.68
    bromobenzene 4226.5
    dibromomethane 2765.05
    1,1,2,2-tetrachloroethane 4801.49
    2-methyl-cyclohexyl acetate 1134.82
    tetrabutyl urea 888.43
    diisobutyl methanol 465.92
    2-phenylethanol 1117.54
    styrene 1672.44
    dioctyl adipate 931.93
    dimethyl sulfate 1735.81
    ethyl butyrate 1320.96
    methyl lactate 657.89
    butyl lactate 714.04
    diethyl carbonate 787.4
    propanediol butyl ether 746.43
    triethyl orthoformate 991.92
    p-tert-butyltoluene 673.75
    methyl 4-tert-butylbenzoate 1096.7
    morpholine 4724.45
    tert-butylamine 559.01
    n-dodecanol 275.06
    dimethoxymethane 3254.24
    ethylene carbonate 1668.91
    cyrene 1224.63
    2-ethoxyethyl acetate 1851.01
    2-ethylhexyl acetate 1548.88
    1,2,4-trichlorobenzene 2741.9
    4-methylpyridine 6247.62
    dibutyl ether 1225.41
    2,6-dimethyl-4-heptanol 465.92
    DEF 3124.07
    dimethyl isosorbide 2441.71
    tetrachloroethylene 2576.43
    eugenol 1013.9
    triacetin 1335.61
    span 80 966.64
    1,4-butanediol 241.96
    1,1-dichloroethane 2741.6
    2-methyl-1-pentanol 503.69
    methyl formate 1465.2
    2-methyl-1-butanol 591.5
    n-decane 170.15
    butyronitrile 1415.49
    3,7-dimethyl-1-octanol 545.62
    1-chlorooctane 593.42
    1-chlorotetradecane 285.64
    n-nonane 175.63
    undecane 130.37
    tert-butylcyclohexane 281.3
    cyclooctane 442.03
    cyclopentanol 1260.95
    tetrahydropyran 4856.23
    tert-amyl methyl ether 1410.03
    2,5,8-trioxanonane 1994.37
    1-hexene 691.49
    2-isopropoxyethanol 704.01
    2,2,2-trifluoroethanol 301.66
    methyl butyrate 1529.74

    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
Scallion (Cuba) Allium fistulosum L., fam. Liliaceae 0.9%