Molecular formula
C10H18OS

SMILES
CC(C)CC(=O)SCC=C(C)C

Safety labels

Fruity	85.49%
Sulfurous	84.67%
Tropical	81.06%
Green	51.14%
Herbal	44.28%
Black currant	42.44%
Cheesy	41.27%
Vegetable	39.26%
Grapefruit	35.49%
Onion	33.41%

Scent© AI

XLogP3-AA
3.4

pKa est.
8.46 (weak base)

Molecular weight
186.32 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Moderately slow

Boiling point est.
237°C

Flash point est.
85.38 ˚C

• S-PRENYL THIOISOPENTANOATE
• 75631-91-3
• 701V2T2HQ7
• UNII-701V2T2HQ7
• Butanethioic acid, 3-methyl-, S-(3-methyl-2-butenyl) ester
• Butanethioic acid, 3-methyl-, S-(3-methyl-2-buten-1-yl) ester
• PRENYL THIOISOVALERATE
• FEMA NO. 4761
• S-(3-Methylbut-2-en-1-yl) 3-methylbutanethioate
• S-3-METHYLBUT-2-ENYL 3-METHYLBUTANETHIOATE
• S-prenyl thioisovalerate
• DTXSID60703702
• NS00126712
• Q27265812

Solvent	Solubility (g/L)
ethanol	1391.42
methanol	839.91
isopropanol	1434.04
water	0.78
ethyl acetate	1275.68
n-propanol	1195.48
acetone	2213.13
n-butanol	1331.2
acetonitrile	1162.02
DMF	1731.09
toluene	843.18
isobutanol	1123.66
1,4-dioxane	1839.16
methyl acetate	1086.75
THF	3394.32
2-butanone	1543.22
n-pentanol	894.98
sec-butanol	1351.99
n-hexane	523.36
ethylene glycol	208.45
NMP	2180.98
cyclohexane	819.52
DMSO	1495.7
n-butyl acetate	1532.02
n-octanol	889.27
chloroform	3946.46
n-propyl acetate	818.87
acetic acid	1335.93
dichloromethane	2671.57
cyclohexanone	2850.8
propylene glycol	518.59
isopropyl acetate	917.5
DMAc	1254.52
2-ethoxyethanol	741.26
isopentanol	1214.1
n-heptane	433.47
ethyl formate	779.09
1,2-dichloroethane	1608.33
n-hexanol	1611.98
2-methoxyethanol	1163.3
isobutyl acetate	639.7
tetrachloromethane	634.2
n-pentyl acetate	884.58
transcutol	2843.88
n-heptanol	687.84
ethylbenzene	557.97
MIBK	997.35
2-propoxyethanol	1521.52
tert-butanol	1860.46
MTBE	1558.64
2-butoxyethanol	863.3
propionic acid	1006.03
o-xylene	602.85
formic acid	228.74
diethyl ether	1310.73
m-xylene	728.94
p-xylene	692.15
chlorobenzene	1227.53
dimethyl carbonate	343.22
n-octane	169.27
formamide	279.97
cyclopentanone	2782.9
2-pentanone	1562.88
anisole	840.08
cyclopentyl methyl ether	1888.3
gamma-butyrolactone	2410.95
1-methoxy-2-propanol	1242.72
pyridine	1588.77
3-pentanone	1027.6
furfural	1876.31
n-dodecane	115.35
diethylene glycol	807.56
diisopropyl ether	574.23
tert-amyl alcohol	1517.36
acetylacetone	1420.46
n-hexadecane	133.58
acetophenone	852.2
methyl propionate	893.44
isopentyl acetate	1378.65
trichloroethylene	3625.68
n-nonanol	721.0
cyclohexanol	1723.33
benzyl alcohol	710.5
2-ethylhexanol	1036.8
isooctanol	591.78
dipropyl ether	993.56
1,2-dichlorobenzene	1045.31
ethyl lactate	403.33
propylene carbonate	1624.63
n-methylformamide	693.16
2-pentanol	1191.66
n-pentane	433.14
1-propoxy-2-propanol	1342.38
1-methoxy-2-propyl acetate	1184.8
2-(2-methoxypropoxy) propanol	843.29
mesitylene	509.45
ε-caprolactone	1972.92
p-cymene	462.4
epichlorohydrin	2354.37
1,1,1-trichloroethane	2309.56
2-aminoethanol	509.21
morpholine-4-carbaldehyde	1728.64
sulfolane	2583.8
2,2,4-trimethylpentane	193.32
2-methyltetrahydrofuran	2581.81
n-hexyl acetate	1503.29
isooctane	192.31
2-(2-butoxyethoxy)ethanol	1148.37
sec-butyl acetate	646.81
tert-butyl acetate	1155.88
decalin	324.7
glycerin	523.48
diglyme	1741.92
acrylic acid	792.36
isopropyl myristate	553.45
n-butyric acid	1656.65
acetyl acetate	821.13
di(2-ethylhexyl) phthalate	455.73
ethyl propionate	634.43
nitromethane	1620.21
1,2-diethoxyethane	1157.98
benzonitrile	1135.66
trioctyl phosphate	365.03
1-bromopropane	1291.68
gamma-valerolactone	2723.39
n-decanol	513.54
triethyl phosphate	378.98
4-methyl-2-pentanol	690.95
propionitrile	940.04
vinylene carbonate	1255.45
1,1,2-trichlorotrifluoroethane	1524.3
DMS	712.65
cumene	407.39
2-octanol	614.45
2-hexanone	1101.86
octyl acetate	700.84
limonene	855.28
1,2-dimethoxyethane	1321.41
ethyl orthosilicate	397.01
tributyl phosphate	457.36
diacetone alcohol	1310.51
N,N-dimethylaniline	581.23
acrylonitrile	911.06
aniline	929.42
1,3-propanediol	754.08
bromobenzene	1288.63
dibromomethane	2097.9
1,1,2,2-tetrachloroethane	3105.82
2-methyl-cyclohexyl acetate	836.69
tetrabutyl urea	590.35
diisobutyl methanol	627.16
2-phenylethanol	870.98
styrene	650.76
dioctyl adipate	684.56
dimethyl sulfate	528.48
ethyl butyrate	845.54
methyl lactate	514.2
butyl lactate	704.99
diethyl carbonate	521.72
propanediol butyl ether	1040.41
triethyl orthoformate	587.58
p-tert-butyltoluene	459.27
methyl 4-tert-butylbenzoate	800.98
morpholine	2262.63
tert-butylamine	1344.72
n-dodecanol	392.46
dimethoxymethane	934.12
ethylene carbonate	1087.16
cyrene	751.86
2-ethoxyethyl acetate	920.32
2-ethylhexyl acetate	1055.89
1,2,4-trichlorobenzene	1338.17
4-methylpyridine	1836.07
dibutyl ether	1049.45
2,6-dimethyl-4-heptanol	627.16
DEF	1237.19
dimethyl isosorbide	1459.62
tetrachloroethylene	1678.64
eugenol	723.34
triacetin	958.93
span 80	952.63
1,4-butanediol	355.93
1,1-dichloroethane	2115.86
2-methyl-1-pentanol	840.97
methyl formate	609.87
2-methyl-1-butanol	1113.46
n-decane	214.99
butyronitrile	1340.93
3,7-dimethyl-1-octanol	865.73
1-chlorooctane	724.2
1-chlorotetradecane	276.92
n-nonane	233.69
undecane	151.19
tert-butylcyclohexane	307.85
cyclooctane	277.1
cyclopentanol	1567.25
tetrahydropyran	2517.88
tert-amyl methyl ether	1146.54
2,5,8-trioxanonane	1144.41
1-hexene	1098.11
2-isopropoxyethanol	691.83
2,2,2-trifluoroethanol	406.85
methyl butyrate	912.36

Scent© AI