1-(Prop-1-enyldisulfanyl)-1-(propyldisulfanyl)propane
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Identifiers
Molecular formula
C9H18S4SMILES
CCCSSC(CC)SSC=CC
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Odor profile
Fragrance Onion 82.24% Sulfurous 75.91% Garlic 74.32% Alliaceous 65.31% Savory 54.55% Roasted 53.92% Cooked 50.72% Pungent 43.29% Meaty 38.95% Cabbage 28.47% Flavor Onion 70.71% Garlic 61.68% Sulfurous 60.13% Alliaceous 49.0% Green 45.83% Metallic 36.3% Cooked 30.47% Cabbage 29.75% Sulfury 27.18% Radish 26.96% Odor impact est.
High -
Properties
XLogP3-AA
4.3pKa est.
4.45 (weak acid)Molecular weight
254.5 g/molVapor pressure est.
- hPa @ 20°C
- hPa @ 25°C
Evaporation rate
Ultra slowBoiling point est.
318°CFlash point
- 151.4 ˚C est.
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Synonyms
- 6-ethyl-4,5,7,8-tetrathia-2-undecene
- MMZWJALGNZCSLI-UHFFFAOYSA-N
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Applications
1-(Prop-1-enyldisulfanyl)-1-(propyldisulfanyl)propane is a multifunctional organosulfur compound with two disulfanyl groups and an allyl substituent, often considered as an intermediate and a crosslinking component in polymer formulations. Real-world applications may include crosslinking agents for coatings, paints, and adhesives to enhance network integrity via thiol-ene or thioether formation; building blocks for rubber and plastics systems, providing sulfur for vulcanization or enabling sulfur-containing linkages in polymer networks; feedstocks for synthesizing more complex sulfidic and thioether compounds used in electronics or optical materials; and potential fragrance or cosmetic components as odorants or linking additives, subject to regulatory limits. CAS number:
gpt-5-nano
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Solubility @25˚C
Solvent Solubility (g/L) ethanol 1023.9 methanol 576.36 isopropanol 909.29 water 0.03 ethyl acetate 4067.26 n-propanol 1007.0 acetone 7607.81 n-butanol 1174.86 acetonitrile 2062.51 DMF 7879.11 toluene 6159.52 isobutanol 868.18 1,4-dioxane 8019.21 methyl acetate 2860.53 THF 13480.7 2-butanone 4471.01 n-pentanol 764.21 sec-butanol 895.91 n-hexane 414.11 ethylene glycol 94.87 NMP 7808.98 cyclohexane 2527.3 DMSO 6300.15 n-butyl acetate 3784.39 n-octanol 628.5 chloroform 7859.2 n-propyl acetate 2100.25 acetic acid 1137.47 dichloromethane 7847.29 cyclohexanone 12506.11 propylene glycol 220.55 isopropyl acetate 2557.07 DMAc 4871.35 2-ethoxyethanol 1140.37 isopentanol 1111.07 n-heptane 648.17 ethyl formate 1754.1 1,2-dichloroethane 6176.15 n-hexanol 1198.25 2-methoxyethanol 2009.66 isobutyl acetate 1358.59 tetrachloromethane 1478.93 n-pentyl acetate 1888.04 transcutol 4187.62 n-heptanol 518.94 ethylbenzene 1416.11 MIBK 2441.83 2-propoxyethanol 1809.76 tert-butanol 1339.85 MTBE 2811.7 2-butoxyethanol 932.85 propionic acid 893.73 o-xylene 2118.12 formic acid 120.17 diethyl ether 3839.41 m-xylene 2678.11 p-xylene 1712.53 chlorobenzene 5049.98 dimethyl carbonate 1265.72 n-octane 205.13 formamide 373.95 cyclopentanone 11676.07 2-pentanone 4889.57 anisole 2554.01 cyclopentyl methyl ether 6682.9 gamma-butyrolactone 7748.26 1-methoxy-2-propanol 1498.83 pyridine 9814.88 3-pentanone 3634.55 furfural 5991.53 n-dodecane 125.98 diethylene glycol 763.16 diisopropyl ether 1187.97 tert-amyl alcohol 1127.54 acetylacetone 5715.92 n-hexadecane 160.31 acetophenone 2435.71 methyl propionate 2886.69 isopentyl acetate 2902.94 trichloroethylene 12629.25 n-nonanol 580.86 cyclohexanol 2541.92 benzyl alcohol 1359.49 2-ethylhexanol 1035.77 isooctanol 470.71 dipropyl ether 2599.51 1,2-dichlorobenzene 3568.7 ethyl lactate 520.17 propylene carbonate 3429.19 n-methylformamide 1732.7 2-pentanol 921.16 n-pentane 494.9 1-propoxy-2-propanol 1675.61 1-methoxy-2-propyl acetate 2982.41 2-(2-methoxypropoxy) propanol 1026.36 mesitylene 1506.86 ε-caprolactone 5892.69 p-cymene 976.89 epichlorohydrin 8289.85 1,1,1-trichloroethane 6716.55 2-aminoethanol 267.22 morpholine-4-carbaldehyde 6653.8 sulfolane 8940.0 2,2,4-trimethylpentane 216.96 2-methyltetrahydrofuran 8431.33 n-hexyl acetate 2178.72 isooctane 210.06 2-(2-butoxyethoxy)ethanol 1387.58 sec-butyl acetate 1435.58 tert-butyl acetate 3113.78 decalin 564.17 glycerin 283.8 diglyme 3422.16 acrylic acid 753.62 isopropyl myristate 901.11 n-butyric acid 1999.08 acetyl acetate 2351.74 di(2-ethylhexyl) phthalate 686.0 ethyl propionate 1700.31 nitromethane 3661.76 1,2-diethoxyethane 3355.76 benzonitrile 3206.37 trioctyl phosphate 507.44 1-bromopropane 3560.72 gamma-valerolactone 11994.09 n-decanol 435.29 triethyl phosphate 827.42 4-methyl-2-pentanol 557.92 propionitrile 1696.78 vinylene carbonate 3030.32 1,1,2-trichlorotrifluoroethane 3272.04 DMS 1775.16 cumene 670.07 2-octanol 451.98 2-hexanone 2358.86 octyl acetate 1040.87 limonene 1978.75 1,2-dimethoxyethane 3781.24 ethyl orthosilicate 840.0 tributyl phosphate 706.38 diacetone alcohol 2092.06 N,N-dimethylaniline 1478.18 acrylonitrile 2079.2 aniline 2947.05 1,3-propanediol 595.3 bromobenzene 6683.79 dibromomethane 5205.02 1,1,2,2-tetrachloroethane 8136.35 2-methyl-cyclohexyl acetate 1672.37 tetrabutyl urea 1101.9 diisobutyl methanol 755.42 2-phenylethanol 1582.03 styrene 2289.05 dioctyl adipate 1217.36 dimethyl sulfate 1961.38 ethyl butyrate 2259.29 methyl lactate 726.77 butyl lactate 950.6 diethyl carbonate 1196.71 propanediol butyl ether 779.96 triethyl orthoformate 1570.78 p-tert-butyltoluene 970.15 methyl 4-tert-butylbenzoate 1465.2 morpholine 7878.57 tert-butylamine 897.8 n-dodecanol 355.77 dimethoxymethane 4281.51 ethylene carbonate 2686.42 cyrene 1391.49 2-ethoxyethyl acetate 2584.66 2-ethylhexyl acetate 2580.01 1,2,4-trichlorobenzene 3763.86 4-methylpyridine 9893.34 dibutyl ether 1907.08 2,6-dimethyl-4-heptanol 755.42 DEF 5148.13 dimethyl isosorbide 2864.49 tetrachloroethylene 4613.36 eugenol 1136.23 triacetin 1703.81 span 80 1121.45 1,4-butanediol 239.28 1,1-dichloroethane 5464.99 2-methyl-1-pentanol 760.12 methyl formate 1626.39 2-methyl-1-butanol 999.92 n-decane 237.88 butyronitrile 2513.83 3,7-dimethyl-1-octanol 764.8 1-chlorooctane 897.86 1-chlorotetradecane 356.67 n-nonane 250.73 undecane 163.46 tert-butylcyclohexane 373.52 cyclooctane 794.72 cyclopentanol 2100.12 tetrahydropyran 10052.57 tert-amyl methyl ether 2065.72 2,5,8-trioxanonane 2084.4 1-hexene 1207.39 2-isopropoxyethanol 838.32 2,2,2-trifluoroethanol 352.24 methyl butyrate 2513.23 Scent© AI
| 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 |
| Name | CAS | Botanical | Proportion |
|---|---|---|---|
| Onion, welsh | 8002-72-0 | Allium fistulosum L. var. Maichuon, fam. Liliaceae | 0.13% |
| Scallion | Allium fistulosum L. var. Caespitosum, fam. Liliaceae | 0.02% |