Molecular formula
C12H18S2

SMILES
CC=CC(C=C)SSC(C=C)C=CC

Fragrance
Onion	60.41%
Garlic	49.66%
Sulfurous	44.97%
Alliaceous	42.75%
Pungent	39.33%
Roasted	36.47%
Cooked	31.54%
Savory	31.36%
Meaty	30.66%
Metallic	29.7%

 

Flavor
Sulfurous	50.01%
Alliaceous	44.78%
Onion	41.27%
Garlic	35.12%
Cooked	22.72%
Metallic	22.26%
Oriental	21.59%
Nitrile	21.23%
Matches	20.85%
Greasy	20.68%

 

Odor impact est.
Medium

XLogP3-AA
4.4

pKa est.
5.61 (weak acid)

Molecular weight
226.4 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Slow

Boiling point est.
259°C

Flash point

• 123.37 ˚C est.

• 1-propenylallyl disulfide
• DTXSID60723960
• 3-[(Hexa-1,4-dien-3-yl)disulfanyl]hexa-1,4-diene

3-[(Hexa-1,4-dien-3-yl)disulfanyl]hexa-1,4-diene is commonly evaluated as a reactive crosslinking agent and intermediate in polymer and coating formulations, with the disulfide linkage enabling covalent bonding and potential reversible crosslinking under appropriate conditions; typical applications include adhesives and sealants, coatings and inks, polymers/plastics formulations, electronics-related encapsulants or specialty materials, and use as an intermediate in specialty chemical syntheses, all subject to local regulations and formulation limits. CAS number:

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	261.32
methanol	120.21
isopropanol	309.15
water	0.01
ethyl acetate	1776.17
n-propanol	330.41
acetone	3162.0
n-butanol	410.63
acetonitrile	786.25
DMF	3212.85
toluene	2345.48
isobutanol	326.79
1,4-dioxane	3114.36
methyl acetate	1401.68
THF	6876.37
2-butanone	2010.27
n-pentanol	288.41
sec-butanol	368.87
n-hexane	353.57
ethylene glycol	27.16
NMP	4241.47
cyclohexane	1416.61
DMSO	2526.13
n-butyl acetate	1628.7
n-octanol	318.21
chloroform	3820.22
n-propyl acetate	976.77
acetic acid	394.11
dichloromethane	3730.75
cyclohexanone	5146.67
propylene glycol	80.38
isopropyl acetate	1140.74
DMAc	2365.79
2-ethoxyethanol	402.83
isopentanol	430.92
n-heptane	455.97
ethyl formate	710.81
1,2-dichloroethane	3110.45
n-hexanol	521.13
2-methoxyethanol	640.38
isobutyl acetate	653.59
tetrachloromethane	814.21
n-pentyl acetate	896.97
transcutol	1750.28
n-heptanol	253.73
ethylbenzene	727.02
MIBK	1108.64
2-propoxyethanol	718.87
tert-butanol	565.58
MTBE	1335.57
2-butoxyethanol	413.99
propionic acid	395.2
o-xylene	1009.38
formic acid	33.55
diethyl ether	1716.27
m-xylene	1114.49
p-xylene	853.68
chlorobenzene	2194.14
dimethyl carbonate	635.85
n-octane	147.32
formamide	116.27
cyclopentanone	6423.86
2-pentanone	2050.16
anisole	1180.38
cyclopentyl methyl ether	3389.48
gamma-butyrolactone	4567.25
1-methoxy-2-propanol	615.44
pyridine	3438.39
3-pentanone	1774.39
furfural	2878.62
n-dodecane	79.29
diethylene glycol	280.43
diisopropyl ether	633.56
tert-amyl alcohol	531.55
acetylacetone	2322.59
n-hexadecane	100.61
acetophenone	1100.98
methyl propionate	1390.42
isopentyl acetate	1278.3
trichloroethylene	5629.64
n-nonanol	294.0
cyclohexanol	1049.87
benzyl alcohol	559.39
2-ethylhexanol	533.86
isooctanol	244.95
dipropyl ether	1358.54
1,2-dichlorobenzene	1740.34
ethyl lactate	285.11
propylene carbonate	1990.48
n-methylformamide	650.44
2-pentanol	394.7
n-pentane	316.3
1-propoxy-2-propanol	761.07
1-methoxy-2-propyl acetate	1355.55
2-(2-methoxypropoxy) propanol	469.65
mesitylene	720.59
ε-caprolactone	2746.52
p-cymene	507.18
epichlorohydrin	4314.09
1,1,1-trichloroethane	3415.79
2-aminoethanol	81.41
morpholine-4-carbaldehyde	2559.53
sulfolane	5308.46
2,2,4-trimethylpentane	145.79
2-methyltetrahydrofuran	4110.77
n-hexyl acetate	1070.32
isooctane	128.44
2-(2-butoxyethoxy)ethanol	639.85
sec-butyl acetate	722.83
tert-butyl acetate	1402.72
decalin	355.5
glycerin	106.94
diglyme	1476.93
acrylic acid	320.03
isopropyl myristate	464.28
n-butyric acid	850.64
acetyl acetate	1013.99
di(2-ethylhexyl) phthalate	337.49
ethyl propionate	875.27
nitromethane	1366.77
1,2-diethoxyethane	1471.67
benzonitrile	1250.53
trioctyl phosphate	254.33
1-bromopropane	1901.7
gamma-valerolactone	4654.56
n-decanol	224.58
triethyl phosphate	472.86
4-methyl-2-pentanol	266.09
propionitrile	736.66
vinylene carbonate	1498.58
1,1,2-trichlorotrifluoroethane	1531.37
DMS	883.7
cumene	381.09
2-octanol	239.67
2-hexanone	1066.51
octyl acetate	526.21
limonene	981.65
1,2-dimethoxyethane	1469.66
ethyl orthosilicate	457.55
tributyl phosphate	336.55
diacetone alcohol	946.28
N,N-dimethylaniline	767.63
acrylonitrile	828.84
aniline	1208.91
1,3-propanediol	181.13
bromobenzene	2831.04
dibromomethane	2768.16
1,1,2,2-tetrachloroethane	4157.6
2-methyl-cyclohexyl acetate	881.52
tetrabutyl urea	504.38
diisobutyl methanol	392.73
2-phenylethanol	654.65
styrene	1044.99
dioctyl adipate	611.88
dimethyl sulfate	1136.03
ethyl butyrate	1141.35
methyl lactate	382.66
butyl lactate	480.72
diethyl carbonate	665.73
propanediol butyl ether	345.55
triethyl orthoformate	780.73
p-tert-butyltoluene	506.83
methyl 4-tert-butylbenzoate	734.23
morpholine	3096.11
tert-butylamine	415.82
n-dodecanol	185.85
dimethoxymethane	1804.85
ethylene carbonate	1303.93
cyrene	693.76
2-ethoxyethyl acetate	1098.96
2-ethylhexyl acetate	1149.16
1,2,4-trichlorobenzene	1893.09
4-methylpyridine	3547.53
dibutyl ether	1014.69
2,6-dimethyl-4-heptanol	392.73
DEF	2196.83
dimethyl isosorbide	1412.38
tetrachloroethylene	2351.97
eugenol	532.42
triacetin	878.94
span 80	525.13
1,4-butanediol	83.51
1,1-dichloroethane	2895.78
2-methyl-1-pentanol	319.93
methyl formate	684.21
2-methyl-1-butanol	409.56
n-decane	157.68
butyronitrile	942.84
3,7-dimethyl-1-octanol	394.79
1-chlorooctane	557.59
1-chlorotetradecane	211.35
n-nonane	174.22
undecane	105.59
tert-butylcyclohexane	252.77
cyclooctane	521.98
cyclopentanol	1046.8
tetrahydropyran	4255.17
tert-amyl methyl ether	1079.59
2,5,8-trioxanonane	903.0
1-hexene	729.39
2-isopropoxyethanol	364.11
2,2,2-trifluoroethanol	157.36
methyl butyrate	1192.67

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