Molecular formula
C11H20O2

SMILES
CCCCC(CC)CC(=O)OC=C

Fragrance
Fruity	83.03%
Green	60.15%
Tropical	40.39%
Waxy	37.86%
Fatty	37.18%
Pineapple	34.75%
Oily	30.48%
Apple	29.94%
Winey	28.34%
Herbal	27.02%

 

Flavor
Fruity	59.01%
Green	45.6%
Oily	39.17%
Waxy	32.45%
Fatty	31.24%
Herbal	30.71%
Tropical	30.43%
Floral	27.32%
Cheese	26.42%
Mushroom	23.98%

 

Odor impact est.
Medium

XLogP3-AA
4.0

pKa est.
8.26 (weak base)

Molecular weight
184.27 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Moderate

Boiling point est.
207°C

Flash point

• 81.77 ˚C est.

• SCHEMBL10433679

Ethenyl 3-ethylheptanoate is primarily used as a reactive monomer and intermediate in polymers and specialty resins; in polymers/plastics, it can be incorporated into vinyl ester resins to tailor flexibility and adhesion. In coatings and inks, it serves as a reactive diluent or comonomer for UV- or free-radical-cured systems, contributing to film formation and performance. In adhesives, it acts as a vinyl ester monomer that can participate in crosslinking to improve adhesion and chemical resistance. In industrial manufacturing, it is a useful building block for synthesizing branched esters and specialty chemicals. In fragrance/perfumery, it may be used as an odor-active ester component, contributing fruity or green notes in complex formulations. In cosmetics/personal care, it can be used as an intermediate in formulating fragrance ingredients or other scent-related additives within regulated formulations.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	1873.84
methanol	1860.25
isopropanol	1641.43
water	0.04
ethyl acetate	1807.71
n-propanol	1718.27
acetone	3168.34
n-butanol	1675.19
acetonitrile	1234.17
DMF	3108.87
toluene	1034.24
isobutanol	1280.52
1,4-dioxane	1998.09
methyl acetate	1402.49
THF	4392.38
2-butanone	2393.11
n-pentanol	1171.62
sec-butanol	1550.64
n-hexane	333.7
ethylene glycol	123.12
NMP	2532.81
cyclohexane	459.54
DMSO	3061.21
n-butyl acetate	1689.79
n-octanol	366.92
chloroform	3114.98
n-propyl acetate	1123.48
acetic acid	909.66
dichloromethane	2928.15
cyclohexanone	3777.48
propylene glycol	320.92
isopropyl acetate	1099.15
DMAc	1769.13
2-ethoxyethanol	810.99
isopentanol	1400.12
n-heptane	95.99
ethyl formate	891.41
1,2-dichloroethane	2344.47
n-hexanol	1321.73
2-methoxyethanol	1514.98
isobutyl acetate	657.56
tetrachloromethane	377.48
n-pentyl acetate	690.74
transcutol	2894.7
n-heptanol	348.62
ethylbenzene	496.37
MIBK	1025.71
2-propoxyethanol	1424.36
tert-butanol	1689.55
MTBE	1823.54
2-butoxyethanol	590.03
propionic acid	949.48
o-xylene	533.34
formic acid	157.57
diethyl ether	1772.25
m-xylene	641.23
p-xylene	610.8
chlorobenzene	1326.47
dimethyl carbonate	305.89
n-octane	35.86
formamide	263.21
cyclopentanone	3372.4
2-pentanone	2096.9
anisole	825.09
cyclopentyl methyl ether	2042.19
gamma-butyrolactone	2897.56
1-methoxy-2-propanol	1307.63
pyridine	2415.14
3-pentanone	1273.47
furfural	1892.57
n-dodecane	24.78
diethylene glycol	643.9
diisopropyl ether	483.45
tert-amyl alcohol	1546.15
acetylacetone	1552.09
n-hexadecane	30.86
acetophenone	743.46
methyl propionate	1219.34
isopentyl acetate	1418.78
trichloroethylene	3850.51
n-nonanol	310.53
cyclohexanol	1667.64
benzyl alcohol	685.82
2-ethylhexanol	683.35
isooctanol	298.9
dipropyl ether	752.76
1,2-dichlorobenzene	991.2
ethyl lactate	327.56
propylene carbonate	1395.9
n-methylformamide	991.19
2-pentanol	1139.41
n-pentane	198.8
1-propoxy-2-propanol	1147.23
1-methoxy-2-propyl acetate	1136.69
2-(2-methoxypropoxy) propanol	629.49
mesitylene	378.01
ε-caprolactone	2293.4
p-cymene	262.43
epichlorohydrin	3040.92
1,1,1-trichloroethane	2099.84
2-aminoethanol	417.34
morpholine-4-carbaldehyde	1676.71
sulfolane	3224.32
2,2,4-trimethylpentane	88.24
2-methyltetrahydrofuran	3475.31
n-hexyl acetate	982.74
isooctane	74.07
2-(2-butoxyethoxy)ethanol	879.19
sec-butyl acetate	734.4
tert-butyl acetate	1167.4
decalin	167.39
glycerin	301.42
diglyme	1515.63
acrylic acid	635.4
isopropyl myristate	324.78
n-butyric acid	1722.65
acetyl acetate	709.52
di(2-ethylhexyl) phthalate	296.94
ethyl propionate	869.09
nitromethane	1536.54
1,2-diethoxyethane	1170.59
benzonitrile	1063.01
trioctyl phosphate	213.9
1-bromopropane	1709.31
gamma-valerolactone	2963.78
n-decanol	212.4
triethyl phosphate	269.67
4-methyl-2-pentanol	546.71
propionitrile	1272.83
vinylene carbonate	1105.54
1,1,2-trichlorotrifluoroethane	1432.72
DMS	620.19
cumene	306.31
2-octanol	271.49
2-hexanone	1435.45
octyl acetate	415.16
limonene	472.91
1,2-dimethoxyethane	1877.59
ethyl orthosilicate	268.28
tributyl phosphate	290.76
diacetone alcohol	1119.25
N,N-dimethylaniline	508.94
acrylonitrile	1317.8
aniline	1021.34
1,3-propanediol	722.12
bromobenzene	1526.16
dibromomethane	2184.52
1,1,2,2-tetrachloroethane	3109.16
2-methyl-cyclohexyl acetate	629.59
tetrabutyl urea	370.9
diisobutyl methanol	330.77
2-phenylethanol	722.83
styrene	689.26
dioctyl adipate	466.79
dimethyl sulfate	541.6
ethyl butyrate	832.66
methyl lactate	424.19
butyl lactate	504.57
diethyl carbonate	459.05
propanediol butyl ether	599.25
triethyl orthoformate	468.88
p-tert-butyltoluene	260.18
methyl 4-tert-butylbenzoate	518.94
morpholine	2994.56
tert-butylamine	1088.34
n-dodecanol	153.9
dimethoxymethane	1307.01
ethylene carbonate	951.67
cyrene	518.73
2-ethoxyethyl acetate	829.62
2-ethylhexyl acetate	998.32
1,2,4-trichlorobenzene	1147.44
4-methylpyridine	2649.53
dibutyl ether	687.05
2,6-dimethyl-4-heptanol	330.77
DEF	1855.83
dimethyl isosorbide	1069.69
tetrachloroethylene	1720.08
eugenol	533.45
triacetin	642.4
span 80	608.77
1,4-butanediol	285.0
1,1-dichloroethane	2524.69
2-methyl-1-pentanol	992.7
methyl formate	646.79
2-methyl-1-butanol	1319.44
n-decane	48.25
butyronitrile	1627.38
3,7-dimethyl-1-octanol	470.66
1-chlorooctane	306.9
1-chlorotetradecane	98.56
n-nonane	49.79
undecane	33.06
tert-butylcyclohexane	151.56
cyclooctane	105.02
cyclopentanol	1634.4
tetrahydropyran	3508.43
tert-amyl methyl ether	1194.59
2,5,8-trioxanonane	939.52
1-hexene	1188.85
2-isopropoxyethanol	661.92
2,2,2-trifluoroethanol	181.67
methyl butyrate	1379.79

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