Molecular formula
C6H12O2S2

SMILES
CCOC(=O)[C@H](C)SSC

Fragrance
Fruity	89.08%
Sulfurous	82.87%
Tropical	79.61%
Green	72.93%
Onion	57.31%
Vegetable	44.94%
Alliaceous	44.35%
Pineapple	42.99%
Sweet	41.54%
Meaty	36.71%

 

Flavor
Fruity	63.36%
Sulfury	39.59%
Onion	38.06%
Cabbage	34.67%
Sulfurous	33.99%
Tropical	33.72%
Cooked	33.6%
Meaty	32.44%
Roasted	29.36%
Ripe	27.45%

 

Odor impact est.
High

XLogP3-AA
1.6

pKa est.
6.71 (neutral)

Molecular weight
180.3 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Moderately slow

Boiling point est.
229°C

Flash point

• 86.82 ˚C est.

ethyl (2S)-2-(methyldisulfanyl)propanoate is predominantly used as a chiral building block and sulfur-containing intermediate in fragrance and aroma chemistry, enabling the synthesis of sulfur-rich odorants and disulfide-bearing fragrance components; it is commonly evaluated as an intermediate in the manufacture of specialty chemicals for cosmetics/personal care, household products, and cleaning formulations where fragrance systems are important; in industrial manufacturing it serves as a precursor for sulfur-containing esters and related compounds; it can also function as a reactive building block to introduce thioether and disulfide functionality into polymers and coatings/inks; overall, it acts as a versatile precursor in fragrance chemistry and sulfur-containing materials, subject to local regulations and formulation limits.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	962.18
methanol	1316.52
isopropanol	758.98
water	5.96
ethyl acetate	1029.52
n-propanol	742.11
acetone	1537.14
n-butanol	706.08
acetonitrile	1709.66
DMF	2077.21
toluene	1155.84
isobutanol	599.31
1,4-dioxane	2514.58
methyl acetate	1267.49
THF	1891.81
2-butanone	1227.01
n-pentanol	640.7
sec-butanol	770.21
n-hexane	146.42
ethylene glycol	248.72
NMP	2028.78
cyclohexane	410.0
DMSO	1623.48
n-butyl acetate	842.19
n-octanol	439.25
chloroform	4886.35
n-propyl acetate	796.12
acetic acid	1524.48
dichloromethane	3807.32
cyclohexanone	2390.74
propylene glycol	262.26
isopropyl acetate	659.03
DMAc	1689.58
2-ethoxyethanol	1043.41
isopentanol	598.5
n-heptane	116.01
ethyl formate	900.46
1,2-dichloroethane	2097.1
n-hexanol	584.41
2-methoxyethanol	1420.36
isobutyl acetate	479.55
tetrachloromethane	909.04
n-pentyl acetate	677.36
transcutol	1961.3
n-heptanol	356.73
ethylbenzene	588.96
MIBK	562.47
2-propoxyethanol	973.9
tert-butanol	885.61
MTBE	924.18
2-butoxyethanol	631.99
propionic acid	803.49
o-xylene	682.55
formic acid	547.97
diethyl ether	899.9
m-xylene	644.89
p-xylene	833.97
chlorobenzene	1530.59
dimethyl carbonate	427.14
n-octane	69.13
formamide	802.97
cyclopentanone	2028.34
2-pentanone	915.35
anisole	1129.86
cyclopentyl methyl ether	1102.62
gamma-butyrolactone	2005.68
1-methoxy-2-propanol	912.87
pyridine	2506.69
3-pentanone	789.01
furfural	2624.66
n-dodecane	59.21
diethylene glycol	713.33
diisopropyl ether	310.52
tert-amyl alcohol	823.44
acetylacetone	1190.21
n-hexadecane	69.38
acetophenone	1103.83
methyl propionate	784.75
isopentyl acetate	683.96
trichloroethylene	4591.66
n-nonanol	356.17
cyclohexanol	1127.04
benzyl alcohol	970.46
2-ethylhexanol	409.24
isooctanol	298.07
dipropyl ether	465.33
1,2-dichlorobenzene	1397.07
ethyl lactate	353.05
propylene carbonate	1178.32
n-methylformamide	1162.9
2-pentanol	513.91
n-pentane	134.32
1-propoxy-2-propanol	643.98
1-methoxy-2-propyl acetate	666.24
2-(2-methoxypropoxy) propanol	543.25
mesitylene	418.55
ε-caprolactone	1852.37
p-cymene	316.8
epichlorohydrin	2196.05
1,1,1-trichloroethane	2291.59
2-aminoethanol	439.16
morpholine-4-carbaldehyde	2221.49
sulfolane	2138.02
2,2,4-trimethylpentane	89.48
2-methyltetrahydrofuran	1629.34
n-hexyl acetate	878.01
isooctane	61.05
2-(2-butoxyethoxy)ethanol	746.95
sec-butyl acetate	521.95
tert-butyl acetate	698.23
decalin	175.05
glycerin	412.53
diglyme	1610.47
acrylic acid	816.36
isopropyl myristate	315.65
n-butyric acid	1058.84
acetyl acetate	823.71
di(2-ethylhexyl) phthalate	309.88
ethyl propionate	627.65
nitromethane	2759.92
1,2-diethoxyethane	906.16
benzonitrile	1732.59
trioctyl phosphate	218.88
1-bromopropane	1081.33
gamma-valerolactone	2751.5
n-decanol	245.51
triethyl phosphate	317.76
4-methyl-2-pentanol	297.92
propionitrile	1176.58
vinylene carbonate	1454.24
1,1,2-trichlorotrifluoroethane	1617.22
DMS	662.26
cumene	353.23
2-octanol	333.89
2-hexanone	815.29
octyl acetate	397.82
limonene	456.32
1,2-dimethoxyethane	1895.38
ethyl orthosilicate	321.42
tributyl phosphate	284.44
diacetone alcohol	660.91
N,N-dimethylaniline	740.04
acrylonitrile	1542.52
aniline	1110.53
1,3-propanediol	682.59
bromobenzene	1706.57
dibromomethane	2414.76
1,1,2,2-tetrachloroethane	3329.93
2-methyl-cyclohexyl acetate	528.03
tetrabutyl urea	385.53
diisobutyl methanol	248.43
2-phenylethanol	732.82
styrene	862.55
dioctyl adipate	432.09
dimethyl sulfate	653.1
ethyl butyrate	593.41
methyl lactate	394.65
butyl lactate	455.74
diethyl carbonate	434.9
propanediol butyl ether	558.91
triethyl orthoformate	427.88
p-tert-butyltoluene	300.76
methyl 4-tert-butylbenzoate	663.13
morpholine	2423.21
tert-butylamine	576.37
n-dodecanol	187.85
dimethoxymethane	999.21
ethylene carbonate	1171.54
cyrene	668.04
2-ethoxyethyl acetate	817.2
2-ethylhexyl acetate	600.96
1,2,4-trichlorobenzene	1586.36
4-methylpyridine	2516.65
dibutyl ether	542.67
2,6-dimethyl-4-heptanol	248.43
DEF	1267.23
dimethyl isosorbide	929.32
tetrachloroethylene	2272.84
eugenol	706.71
triacetin	750.48
span 80	552.26
1,4-butanediol	346.05
1,1-dichloroethane	2142.79
2-methyl-1-pentanol	583.87
methyl formate	1014.39
2-methyl-1-butanol	587.19
n-decane	101.39
butyronitrile	1178.18
3,7-dimethyl-1-octanol	372.86
1-chlorooctane	386.32
1-chlorotetradecane	151.37
n-nonane	104.97
undecane	73.14
tert-butylcyclohexane	140.11
cyclooctane	132.66
cyclopentanol	1010.12
tetrahydropyran	1964.33
tert-amyl methyl ether	714.54
2,5,8-trioxanonane	996.71
1-hexene	476.08
2-isopropoxyethanol	708.96
2,2,2-trifluoroethanol	548.6
methyl butyrate	960.76

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