Molecular formula
C4H8O2S2

SMILES
C1[C@H](SC[C@H](S1)O)O

Fragrance
Meaty	73.89%
Sulfurous	73.66%
Roasted	45.86%
Onion	45.54%
Savory	40.65%
Cooked	38.28%
Garlic	37.13%
Beefy	36.85%
Alliaceous	33.01%
Pungent	26.76%

 

Flavor
Sulfurous	47.29%
Roasted	43.33%
Meaty	33.08%
Onion	31.04%
Chicken	29.74%
Sulfur	27.13%
Sulfury	26.01%
Bouillon	25.0%
Fishy	24.94%
Alliaceous	23.44%

 

Odor impact est.
Medium

XLogP3-AA
0.3

pKa est.
6.48 (neutral)

Molecular weight
152.2 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Ultra slow

Boiling point est.
376°C

Flash point

• 155.66 ˚C est.

(2S,5S)-1,4-dithiane-2,5-diol is a sulfur-containing dithiane derivative used as a versatile building block in organic synthesis and polymer-related applications. It is commonly employed as an intermediate and as a diol-containing monomer or crosslinking component for specialty polymers and resins. It can serve as a masked carbonyl reagent in dithiane chemistry, enabling carbon–carbon bond formation, and may function as a crosslinker or functional modifier in coatings, inks, and adhesives. In industrial manufacturing, it is evaluated as a precursor for sulfur-containing materials and related specialty chemicals. In certain formulations it may act as a chelating or stabilizing component in cleaners or finishing formulations and can appear in niche electronics-related materials where sulfur-containing building blocks are relevant.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	14.84
methanol	32.39
isopropanol	7.53
water	106.46
ethyl acetate	4.1
n-propanol	8.8
acetone	6.46
n-butanol	6.63
acetonitrile	2.18
DMF	55.38
toluene	0.83
isobutanol	4.43
1,4-dioxane	11.96
methyl acetate	4.42
THF	28.97
2-butanone	3.73
n-pentanol	5.11
sec-butanol	4.78
n-hexane	0.21
ethylene glycol	37.06
NMP	64.15
cyclohexane	0.45
DMSO	84.59
n-butyl acetate	6.3
n-octanol	8.0
chloroform	5.12
n-propyl acetate	4.15
acetic acid	41.72
dichloromethane	2.92
cyclohexanone	12.46
propylene glycol	16.76
isopropyl acetate	4.15
DMAc	40.51
2-ethoxyethanol	31.33
isopentanol	4.97
n-heptane	1.11
ethyl formate	8.53
1,2-dichloroethane	2.19
n-hexanol	10.55
2-methoxyethanol	55.92
isobutyl acetate	2.77
tetrachloromethane	3.64
n-pentyl acetate	6.89
transcutol	48.15
n-heptanol	11.68
ethylbenzene	0.91
MIBK	4.32
2-propoxyethanol	41.21
tert-butanol	10.32
MTBE	2.24
2-butoxyethanol	34.28
propionic acid	17.46
o-xylene	1.61
formic acid	102.14
diethyl ether	1.9
m-xylene	1.65
p-xylene	1.11
chlorobenzene	1.62
dimethyl carbonate	6.48
n-octane	0.58
formamide	86.77
cyclopentanone	25.43
2-pentanone	4.58
anisole	3.41
cyclopentyl methyl ether	8.31
gamma-butyrolactone	38.67
1-methoxy-2-propanol	34.99
pyridine	6.01
3-pentanone	3.0
furfural	47.83
n-dodecane	0.48
diethylene glycol	64.99
diisopropyl ether	1.37
tert-amyl alcohol	7.38
acetylacetone	11.58
n-hexadecane	0.52
acetophenone	7.16
methyl propionate	5.97
isopentyl acetate	5.82
trichloroethylene	6.13
n-nonanol	7.63
cyclohexanol	6.44
benzyl alcohol	6.7
2-ethylhexanol	6.19
isooctanol	8.39
dipropyl ether	4.7
1,2-dichlorobenzene	3.15
ethyl lactate	11.17
propylene carbonate	18.34
n-methylformamide	37.7
2-pentanol	4.15
n-pentane	0.23
1-propoxy-2-propanol	26.92
1-methoxy-2-propyl acetate	13.65
2-(2-methoxypropoxy) propanol	23.98
mesitylene	1.75
ε-caprolactone	16.57
p-cymene	2.84
epichlorohydrin	16.74
1,1,1-trichloroethane	2.66
2-aminoethanol	36.22
morpholine-4-carbaldehyde	64.44
sulfolane	78.23
2,2,4-trimethylpentane	0.27
2-methyltetrahydrofuran	9.27
n-hexyl acetate	7.22
isooctane	0.31
2-(2-butoxyethoxy)ethanol	33.39
sec-butyl acetate	2.83
tert-butyl acetate	6.53
decalin	0.42
glycerin	63.79
diglyme	51.11
acrylic acid	23.5
isopropyl myristate	3.89
n-butyric acid	16.91
acetyl acetate	5.77
di(2-ethylhexyl) phthalate	6.83
ethyl propionate	3.86
nitromethane	35.57
1,2-diethoxyethane	6.98
benzonitrile	4.43
trioctyl phosphate	6.29
1-bromopropane	0.78
gamma-valerolactone	48.07
n-decanol	5.54
triethyl phosphate	6.73
4-methyl-2-pentanol	3.61
propionitrile	2.15
vinylene carbonate	17.01
1,1,2-trichlorotrifluoroethane	52.79
DMS	5.81
cumene	1.22
2-octanol	6.33
2-hexanone	3.54
octyl acetate	5.36
limonene	3.6
1,2-dimethoxyethane	23.23
ethyl orthosilicate	6.34
tributyl phosphate	5.63
diacetone alcohol	20.03
N,N-dimethylaniline	5.17
acrylonitrile	4.71
aniline	3.92
1,3-propanediol	37.94
bromobenzene	1.15
dibromomethane	1.78
1,1,2,2-tetrachloroethane	7.33
2-methyl-cyclohexyl acetate	7.95
tetrabutyl urea	9.42
diisobutyl methanol	5.26
2-phenylethanol	10.97
styrene	0.82
dioctyl adipate	6.42
dimethyl sulfate	19.61
ethyl butyrate	6.47
methyl lactate	20.32
butyl lactate	13.22
diethyl carbonate	4.55
propanediol butyl ether	26.26
triethyl orthoformate	7.18
p-tert-butyltoluene	3.38
methyl 4-tert-butylbenzoate	18.79
morpholine	16.78
tert-butylamine	4.2
n-dodecanol	4.15
dimethoxymethane	21.2
ethylene carbonate	11.93
cyrene	31.12
2-ethoxyethyl acetate	8.96
2-ethylhexyl acetate	4.54
1,2,4-trichlorobenzene	4.11
4-methylpyridine	4.19
dibutyl ether	2.86
2,6-dimethyl-4-heptanol	5.26
DEF	12.2
dimethyl isosorbide	41.42
tetrachloroethylene	9.41
eugenol	24.06
triacetin	12.41
span 80	22.9
1,4-butanediol	15.97
1,1-dichloroethane	1.34
2-methyl-1-pentanol	3.57
methyl formate	24.63
2-methyl-1-butanol	4.2
n-decane	0.71
butyronitrile	2.19
3,7-dimethyl-1-octanol	6.12
1-chlorooctane	2.22
1-chlorotetradecane	1.12
n-nonane	0.64
undecane	0.56
tert-butylcyclohexane	0.44
cyclooctane	0.37
cyclopentanol	13.04
tetrahydropyran	4.82
tert-amyl methyl ether	2.69
2,5,8-trioxanonane	45.43
1-hexene	0.48
2-isopropoxyethanol	16.52
2,2,2-trifluoroethanol	46.45
methyl butyrate	5.78

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