Molecular formula
C11H18O2

SMILES
C/C=C(\C)/C(=O)OC1CCCCC1

Fragrance
Fruity	81.42%
Floral	77.11%
Herbal	68.67%
Sweet	66.61%
Green	56.23%
Woody	51.09%
Mint	47.15%
Rose	46.27%
Apple	40.19%
Jasmin	39.92%

 

Flavor
Fruity	39.76%
Spicy	37.24%
Herbal	37.21%
Floral	32.6%
Minty	30.88%
Rose	25.97%
Sweet	24.54%
Mint	23.88%
Woody	22.45%
Berry	22.04%

 

Odor impact est.
Medium

XLogP3-AA
3.1

pKa est.
8.28 (weak base)

Molecular weight
182.26 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Moderately slow

Boiling point est.
239°C

Flash point

• 95.64 ˚C est.

• SCHEMBL334029

cyclohexyl (E)-2-methylbut-2-enoate is used as a fragrance ingredient and fixative in perfumery, helping to extend scent longevity; it is also employed in cosmetics/personal care as a fragrance component for products such as creams and cleansers. In household products, it can appear as an odorant additive in cleaners and air fresheners. In coatings and inks, it can serve as an odor-related additive affecting fragrance release in paint and ink systems. In polymers/plastics, it may be considered as a plasticizer or processing aid in specialized polymer formulations. Additionally, cyclohexyl (E)-2-methylbut-2-enoate may be used as an intermediate for synthesizing other fragrance esters.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	1412.64
methanol	990.08
isopropanol	1581.66
water	0.52
ethyl acetate	1627.59
n-propanol	1391.31
acetone	1923.77
n-butanol	1547.99
acetonitrile	1701.66
DMF	1873.92
toluene	1199.93
isobutanol	1364.75
1,4-dioxane	2170.04
methyl acetate	1424.27
THF	2061.15
2-butanone	1999.29
n-pentanol	1113.62
sec-butanol	1899.09
n-hexane	417.56
ethylene glycol	84.43
NMP	1442.29
cyclohexane	719.04
DMSO	934.58
n-butyl acetate	1822.19
n-octanol	839.79
chloroform	6756.09
n-propyl acetate	1238.29
acetic acid	1232.62
dichloromethane	4865.88
cyclohexanone	2835.62
propylene glycol	217.48
isopropyl acetate	1088.23
DMAc	1580.27
2-ethoxyethanol	806.5
isopentanol	1464.77
n-heptane	180.11
ethyl formate	1102.35
1,2-dichloroethane	2771.52
n-hexanol	1261.37
2-methoxyethanol	1066.27
isobutyl acetate	793.1
tetrachloromethane	828.35
n-pentyl acetate	1153.06
transcutol	2855.85
n-heptanol	714.7
ethylbenzene	832.29
MIBK	925.47
2-propoxyethanol	1124.13
tert-butanol	1698.73
MTBE	1753.46
2-butoxyethanol	859.32
propionic acid	1035.9
o-xylene	744.35
formic acid	204.89
diethyl ether	1511.4
m-xylene	717.0
p-xylene	1148.05
chlorobenzene	1950.81
dimethyl carbonate	365.47
n-octane	126.46
formamide	393.14
cyclopentanone	2239.22
2-pentanone	1580.21
anisole	1143.37
cyclopentyl methyl ether	1180.9
gamma-butyrolactone	2242.88
1-methoxy-2-propanol	900.78
pyridine	3155.55
3-pentanone	1108.52
furfural	1978.16
n-dodecane	102.6
diethylene glycol	478.28
diisopropyl ether	490.03
tert-amyl alcohol	1735.03
acetylacetone	1200.91
n-hexadecane	119.1
acetophenone	1090.02
methyl propionate	968.86
isopentyl acetate	1603.82
trichloroethylene	5558.47
n-nonanol	681.51
cyclohexanol	1674.46
benzyl alcohol	880.4
2-ethylhexanol	841.25
isooctanol	630.87
dipropyl ether	711.47
1,2-dichlorobenzene	1645.23
ethyl lactate	389.71
propylene carbonate	1463.03
n-methylformamide	852.23
2-pentanol	1300.37
n-pentane	316.05
1-propoxy-2-propanol	976.45
1-methoxy-2-propyl acetate	918.3
2-(2-methoxypropoxy) propanol	713.96
mesitylene	474.15
ε-caprolactone	2251.78
p-cymene	430.11
epichlorohydrin	2558.7
1,1,1-trichloroethane	3039.52
2-aminoethanol	300.75
morpholine-4-carbaldehyde	1378.88
sulfolane	1771.75
2,2,4-trimethylpentane	164.34
2-methyltetrahydrofuran	2104.29
n-hexyl acetate	1483.24
isooctane	138.24
2-(2-butoxyethoxy)ethanol	1022.01
sec-butyl acetate	846.86
tert-butyl acetate	948.42
decalin	290.6
glycerin	236.3
diglyme	1740.21
acrylic acid	769.39
isopropyl myristate	543.64
n-butyric acid	1787.68
acetyl acetate	941.89
di(2-ethylhexyl) phthalate	419.95
ethyl propionate	948.89
nitromethane	1707.94
1,2-diethoxyethane	1302.51
benzonitrile	1877.57
trioctyl phosphate	312.44
1-bromopropane	2109.06
gamma-valerolactone	2363.41
n-decanol	469.72
triethyl phosphate	373.54
4-methyl-2-pentanol	680.75
propionitrile	1812.75
vinylene carbonate	1445.08
1,1,2-trichlorotrifluoroethane	1335.35
DMS	753.96
cumene	538.07
2-octanol	660.89
2-hexanone	1361.67
octyl acetate	680.55
limonene	599.72
1,2-dimethoxyethane	1729.7
ethyl orthosilicate	370.27
tributyl phosphate	407.5
diacetone alcohol	866.49
N,N-dimethylaniline	706.97
acrylonitrile	1691.92
aniline	1207.33
1,3-propanediol	669.1
bromobenzene	2325.01
dibromomethane	3624.59
1,1,2,2-tetrachloroethane	4489.54
2-methyl-cyclohexyl acetate	730.92
tetrabutyl urea	492.09
diisobutyl methanol	471.2
2-phenylethanol	903.25
styrene	1085.03
dioctyl adipate	641.7
dimethyl sulfate	441.88
ethyl butyrate	1065.96
methyl lactate	346.02
butyl lactate	687.77
diethyl carbonate	695.19
propanediol butyl ether	755.69
triethyl orthoformate	643.28
p-tert-butyltoluene	412.0
methyl 4-tert-butylbenzoate	779.44
morpholine	2357.01
tert-butylamine	1316.74
n-dodecanol	347.33
dimethoxymethane	804.37
ethylene carbonate	1243.18
cyrene	530.87
2-ethoxyethyl acetate	1033.97
2-ethylhexyl acetate	1212.72
1,2,4-trichlorobenzene	1706.7
4-methylpyridine	3154.14
dibutyl ether	1033.97
2,6-dimethyl-4-heptanol	471.2
DEF	1581.19
dimethyl isosorbide	1031.28
tetrachloroethylene	2632.35
eugenol	758.72
triacetin	882.72
span 80	770.34
1,4-butanediol	280.75
1,1-dichloroethane	3683.1
2-methyl-1-pentanol	1133.69
methyl formate	625.35
2-methyl-1-butanol	1461.91
n-decane	179.51
butyronitrile	2286.41
3,7-dimethyl-1-octanol	783.84
1-chlorooctane	700.81
1-chlorotetradecane	256.65
n-nonane	184.34
undecane	129.53
tert-butylcyclohexane	247.38
cyclooctane	191.28
cyclopentanol	1309.72
tetrahydropyran	2772.8
tert-amyl methyl ether	1129.92
2,5,8-trioxanonane	1058.35
1-hexene	1248.76
2-isopropoxyethanol	684.72
2,2,2-trifluoroethanol	319.54
methyl butyrate	1539.28

Scent© AI