5,5-Dimethyltetrathiane
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Identifiers
Molecular formula
C4H8S4SMILES
CC1(CSSSS1)C
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Odor profile
Fragrance Sulfurous 81.68% Onion 65.05% Garlic 57.3% Alliaceous 50.56% Meaty 50.53% Roasted 45.0% Savory 40.13% Cooked 36.61% Vegetable 27.29% Beefy 26.24% Flavor Sulfurous 54.08% Meaty 37.57% Green 35.88% Earthy 34.53% Vegetable 33.62% Onion 31.33% Roasted 30.26% Alliaceous 29.28% Sulfur 28.36% Sulfury 27.67% Odor impact est.
High -
Properties
XLogP3-AA
2.2pKa est.
1.33 (strong acid)Molecular weight
184.4 g/molVapor pressure est.
- hPa @ 20°C
- hPa @ 25°C
Evaporation rate
SlowBoiling point est.
289°CFlash point
- 109.25 ˚C est.
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Synonyms
- 5,5-dimethyltetrathiane
- 5,5-dimethyl-1,2,3,4-tetrathiane
- CHEBI:198904
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Applications
5,5-Dimethyltetrathiane is a cyclic organosulfur compound used primarily as a chemical building block in organosulfur synthesis. In practice, it serves as an intermediate for preparing sulfur-containing heterocycles and related materials. It is evaluated as a polymer processing additive or stabilizer in plastics and rubbers to improve processing and thermal stability. Given its sulfur features, it can be utilized as a fragrance fixative or odorant component in perfumery and flavor contexts. It is also considered as a starting material for coatings and adhesives formulations where sulfur-containing functionalities are beneficial. In some cases, it is explored for specialty applications in electronics or materials science as a precursor to sulfur-containing building blocks, subject to formulation limits and regulations.
gpt-5-nano
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Solubility @25˚C
Solvent Solubility (g/L) ethanol 80.48 methanol 66.1 isopropanol 75.14 water 0.61 ethyl acetate 268.09 n-propanol 81.81 acetone 335.51 n-butanol 93.38 acetonitrile 158.08 DMF 366.92 toluene 300.78 isobutanol 68.64 1,4-dioxane 465.6 methyl acetate 242.68 THF 740.95 2-butanone 274.49 n-pentanol 69.96 sec-butanol 73.11 n-hexane 26.19 ethylene glycol 32.18 NMP 552.71 cyclohexane 74.54 DMSO 303.06 n-butyl acetate 291.05 n-octanol 115.83 chloroform 513.92 n-propyl acetate 179.49 acetic acid 128.08 dichloromethane 365.33 cyclohexanone 557.74 propylene glycol 49.1 isopropyl acetate 222.71 DMAc 323.44 2-ethoxyethanol 138.08 isopentanol 86.97 n-heptane 58.78 ethyl formate 162.03 1,2-dichloroethane 250.61 n-hexanol 147.71 2-methoxyethanol 217.49 isobutyl acetate 159.51 tetrachloromethane 104.99 n-pentyl acetate 204.13 transcutol 478.41 n-heptanol 92.19 ethylbenzene 122.05 MIBK 222.75 2-propoxyethanol 280.47 tert-butanol 113.44 MTBE 175.41 2-butoxyethanol 168.23 propionic acid 108.3 o-xylene 198.14 formic acid 33.76 diethyl ether 186.15 m-xylene 245.14 p-xylene 157.84 chlorobenzene 328.47 dimethyl carbonate 187.14 n-octane 27.26 formamide 54.83 cyclopentanone 663.66 2-pentanone 286.9 anisole 272.44 cyclopentyl methyl ether 405.65 gamma-butyrolactone 581.48 1-methoxy-2-propanol 205.98 pyridine 384.96 3-pentanone 246.81 furfural 597.73 n-dodecane 26.49 diethylene glycol 206.77 diisopropyl ether 107.46 tert-amyl alcohol 97.6 acetylacetone 466.83 n-hexadecane 31.55 acetophenone 277.38 methyl propionate 237.6 isopentyl acetate 270.23 trichloroethylene 566.6 n-nonanol 106.29 cyclohexanol 171.09 benzyl alcohol 167.13 2-ethylhexanol 132.41 isooctanol 79.29 dipropyl ether 199.84 1,2-dichlorobenzene 316.6 ethyl lactate 108.31 propylene carbonate 398.23 n-methylformamide 137.54 2-pentanol 78.82 n-pentane 31.29 1-propoxy-2-propanol 245.3 1-methoxy-2-propyl acetate 379.12 2-(2-methoxypropoxy) propanol 220.24 mesitylene 176.73 ε-caprolactone 432.56 p-cymene 138.43 epichlorohydrin 500.22 1,1,1-trichloroethane 355.06 2-aminoethanol 49.06 morpholine-4-carbaldehyde 568.09 sulfolane 659.6 2,2,4-trimethylpentane 25.49 2-methyltetrahydrofuran 450.15 n-hexyl acetate 278.74 isooctane 26.86 2-(2-butoxyethoxy)ethanol 249.33 sec-butyl acetate 157.82 tert-butyl acetate 301.54 decalin 44.27 glycerin 78.43 diglyme 446.85 acrylic acid 121.82 isopropyl myristate 153.43 n-butyric acid 169.41 acetyl acetate 263.16 di(2-ethylhexyl) phthalate 132.83 ethyl propionate 175.57 nitromethane 283.11 1,2-diethoxyethane 259.98 benzonitrile 290.9 trioctyl phosphate 102.69 1-bromopropane 156.67 gamma-valerolactone 769.54 n-decanol 86.62 triethyl phosphate 137.16 4-methyl-2-pentanol 69.2 propionitrile 138.32 vinylene carbonate 358.86 1,1,2-trichlorotrifluoroethane 329.16 DMS 270.52 cumene 90.18 2-octanol 82.61 2-hexanone 193.8 octyl acetate 175.86 limonene 191.49 1,2-dimethoxyethane 282.93 ethyl orthosilicate 132.53 tributyl phosphate 125.65 diacetone alcohol 259.03 N,N-dimethylaniline 182.64 acrylonitrile 172.84 aniline 222.46 1,3-propanediol 83.11 bromobenzene 374.65 dibromomethane 271.74 1,1,2,2-tetrachloroethane 424.75 2-methyl-cyclohexyl acetate 223.48 tetrabutyl urea 160.9 diisobutyl methanol 108.32 2-phenylethanol 239.83 styrene 158.22 dioctyl adipate 177.97 dimethyl sulfate 285.5 ethyl butyrate 221.65 methyl lactate 146.07 butyl lactate 162.28 diethyl carbonate 156.4 propanediol butyl ether 175.0 triethyl orthoformate 186.07 p-tert-butyltoluene 156.73 methyl 4-tert-butylbenzoate 268.35 morpholine 406.19 tert-butylamine 75.0 n-dodecanol 74.48 dimethoxymethane 320.79 ethylene carbonate 296.94 cyrene 263.1 2-ethoxyethyl acetate 286.08 2-ethylhexyl acetate 244.24 1,2,4-trichlorobenzene 374.78 4-methylpyridine 423.92 dibutyl ether 163.44 2,6-dimethyl-4-heptanol 108.32 DEF 278.39 dimethyl isosorbide 468.67 tetrachloroethylene 259.05 eugenol 229.56 triacetin 292.38 span 80 218.38 1,4-butanediol 45.67 1,1-dichloroethane 261.86 2-methyl-1-pentanol 70.9 methyl formate 160.19 2-methyl-1-butanol 77.47 n-decane 39.1 butyronitrile 158.85 3,7-dimethyl-1-octanol 127.34 1-chlorooctane 115.75 1-chlorotetradecane 60.75 n-nonane 37.96 undecane 31.35 tert-butylcyclohexane 42.91 cyclooctane 45.01 cyclopentanol 178.57 tetrahydropyran 393.53 tert-amyl methyl ether 168.18 2,5,8-trioxanonane 342.36 1-hexene 67.39 2-isopropoxyethanol 124.83 2,2,2-trifluoroethanol 78.22 methyl butyrate 204.93 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 |