2-Methylsulfanylpent-2-ene
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Identifiers
Molecular formula
C6H12SSMILES
CCC=C(C)SC
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Odor profile
Fragrance Sulfurous 80.28% Onion 67.7% Meaty 63.86% Garlic 59.18% Alliaceous 53.69% Savory 51.94% Vegetable 49.41% Roasted 40.81% Cooked 38.8% Tropical 34.23% Flavor Sulfurous 49.84% Green 43.46% Onion 40.95% Meaty 30.07% Garlic 28.82% Sulfury 28.02% Spicy 26.1% Citrus 25.89% Vegetable 24.4% Tropical 23.92% Odor impact est.
High -
Properties
XLogP3-AA
2.4pKa est.
8.53 (weak base)Molecular weight
116.23 g/molVapor pressure est.
- hPa @ 20°C
- hPa @ 25°C
Evaporation rate
Ultra fastBoiling point est.
132°CFlash point
- 23.05 ˚C est.
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Applications
2-Methylsulfanylpent-2-ene is an organosulfur compound that is primarily used as an intermediate in organic synthesis on an industrial scale. Real-world applications include: serving as an intermediate for complex organic synthesis; evaluated for fragrance and flavor chemistry applications; acting as a precursor or modifier for specialty polymers; used as a reactive intermediate in coatings and inks; considered for cosmetics/personal care as a fragrance-related ingredient. Subject to local regulations and formulation limits.
gpt-5-nano
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Solubility @25˚C
Solvent Solubility (g/L) ethanol 1065.47 methanol 694.79 isopropanol 998.76 water 0.43 ethyl acetate 1368.52 n-propanol 1106.77 acetone 1529.8 n-butanol 1318.7 acetonitrile 1139.24 DMF 999.35 toluene 1478.82 isobutanol 940.45 1,4-dioxane 2600.62 methyl acetate 1064.36 THF 3266.74 2-butanone 1531.71 n-pentanol 842.42 sec-butanol 1199.27 n-hexane 830.86 ethylene glycol 111.12 NMP 1437.09 cyclohexane 1460.49 DMSO 1113.37 n-butyl acetate 2116.55 n-octanol 792.94 chloroform 3145.32 n-propyl acetate 859.79 acetic acid 579.59 dichloromethane 2304.52 cyclohexanone 2688.32 propylene glycol 232.0 isopropyl acetate 889.65 DMAc 870.22 2-ethoxyethanol 737.49 isopentanol 1063.54 n-heptane 1277.54 ethyl formate 660.5 1,2-dichloroethane 1479.85 n-hexanol 1897.5 2-methoxyethanol 994.37 isobutyl acetate 584.85 tetrachloromethane 1226.63 n-pentyl acetate 1032.08 transcutol 2173.38 n-heptanol 791.4 ethylbenzene 559.8 MIBK 829.69 2-propoxyethanol 1604.92 tert-butanol 1414.21 MTBE 1694.1 2-butoxyethanol 866.61 propionic acid 673.51 o-xylene 743.47 formic acid 97.17 diethyl ether 2199.22 m-xylene 798.91 p-xylene 608.92 chlorobenzene 1268.41 dimethyl carbonate 268.98 n-octane 366.99 formamide 142.6 cyclopentanone 2238.19 2-pentanone 1443.94 anisole 860.75 cyclopentyl methyl ether 2081.44 gamma-butyrolactone 1650.15 1-methoxy-2-propanol 940.42 pyridine 1911.55 3-pentanone 1204.4 furfural 1371.14 n-dodecane 192.6 diethylene glycol 617.99 diisopropyl ether 793.34 tert-amyl alcohol 1289.33 acetylacetone 1051.17 n-hexadecane 219.07 acetophenone 654.59 methyl propionate 854.4 isopentyl acetate 1483.84 trichloroethylene 2324.87 n-nonanol 671.12 cyclohexanol 1598.02 benzyl alcohol 571.67 2-ethylhexanol 1387.97 isooctanol 653.85 dipropyl ether 2096.91 1,2-dichlorobenzene 1026.82 ethyl lactate 303.95 propylene carbonate 987.92 n-methylformamide 468.48 2-pentanol 1098.35 n-pentane 833.73 1-propoxy-2-propanol 1512.34 1-methoxy-2-propyl acetate 1086.34 2-(2-methoxypropoxy) propanol 642.38 mesitylene 545.63 ε-caprolactone 1866.34 p-cymene 628.6 epichlorohydrin 1805.52 1,1,1-trichloroethane 2197.59 2-aminoethanol 301.09 morpholine-4-carbaldehyde 1435.63 sulfolane 1728.2 2,2,4-trimethylpentane 316.12 2-methyltetrahydrofuran 3007.29 n-hexyl acetate 1200.09 isooctane 271.01 2-(2-butoxyethoxy)ethanol 956.75 sec-butyl acetate 625.53 tert-butyl acetate 1018.07 decalin 440.07 glycerin 260.54 diglyme 1651.46 acrylic acid 441.84 isopropyl myristate 543.9 n-butyric acid 1221.77 acetyl acetate 694.41 di(2-ethylhexyl) phthalate 348.74 ethyl propionate 697.25 nitromethane 850.48 1,2-diethoxyethane 1642.06 benzonitrile 960.8 trioctyl phosphate 317.55 1-bromopropane 1755.97 gamma-valerolactone 1998.57 n-decanol 498.21 triethyl phosphate 413.2 4-methyl-2-pentanol 576.05 propionitrile 1165.68 vinylene carbonate 854.84 1,1,2-trichlorotrifluoroethane 978.79 DMS 529.2 cumene 378.03 2-octanol 626.58 2-hexanone 1021.4 octyl acetate 639.33 limonene 1227.97 1,2-dimethoxyethane 1403.43 ethyl orthosilicate 456.91 tributyl phosphate 380.9 diacetone alcohol 852.02 N,N-dimethylaniline 553.43 acrylonitrile 901.58 aniline 1024.81 1,3-propanediol 524.34 bromobenzene 1480.78 dibromomethane 2039.75 1,1,2,2-tetrachloroethane 2089.7 2-methyl-cyclohexyl acetate 835.2 tetrabutyl urea 466.58 diisobutyl methanol 698.26 2-phenylethanol 836.08 styrene 743.27 dioctyl adipate 559.32 dimethyl sulfate 376.7 ethyl butyrate 1214.95 methyl lactate 312.64 butyl lactate 549.96 diethyl carbonate 625.82 propanediol butyl ether 622.4 triethyl orthoformate 805.96 p-tert-butyltoluene 606.72 methyl 4-tert-butylbenzoate 648.33 morpholine 2520.03 tert-butylamine 1148.72 n-dodecanol 396.48 dimethoxymethane 886.39 ethylene carbonate 825.11 cyrene 541.04 2-ethoxyethyl acetate 971.44 2-ethylhexyl acetate 1388.77 1,2,4-trichlorobenzene 1135.49 4-methylpyridine 1907.3 dibutyl ether 1349.5 2,6-dimethyl-4-heptanol 698.26 DEF 1263.04 dimethyl isosorbide 1116.46 tetrachloroethylene 1469.83 eugenol 566.06 triacetin 678.86 span 80 752.99 1,4-butanediol 227.23 1,1-dichloroethane 1912.79 2-methyl-1-pentanol 760.06 methyl formate 354.71 2-methyl-1-butanol 1092.55 n-decane 337.23 butyronitrile 1529.73 3,7-dimethyl-1-octanol 779.24 1-chlorooctane 815.77 1-chlorotetradecane 338.16 n-nonane 407.29 undecane 240.81 tert-butylcyclohexane 401.7 cyclooctane 596.44 cyclopentanol 1302.07 tetrahydropyran 3502.54 tert-amyl methyl ether 1312.5 2,5,8-trioxanonane 1051.51 1-hexene 1401.25 2-isopropoxyethanol 645.12 2,2,2-trifluoroethanol 173.6 methyl butyrate 894.12 Scent© AI
| Maximum acceptable concentrations in the finished product (%) | |||
|---|---|---|---|
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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 |