Molecular formula
C11H20O2

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

Fragrance
Fruity	86.58%
Green	81.01%
Tropical	56.66%
Pear	54.85%
Waxy	54.62%
Apple	52.9%
Fatty	47.96%
Pineapple	46.96%
Melon	45.28%
Winey	37.0%

 

Flavor
Fruity	69.6%
Tropical	47.61%
Green	44.77%
Pineapple	34.74%
Pear	33.31%
Fresh	32.68%
Apple	32.22%
Oily	29.87%
Waxy	29.74%
Floral	27.96%

 

Odor impact est.
High

XLogP3-AA
3.0

pKa est.
8.37 (weak base)

Molecular weight
184.27 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Moderate

Boiling point est.
209°C

Flash point

• 88.91 ˚C est.

Propan-2-yl oct-5-enoate is primarily encountered as a fragrance ingredient and fixative in perfumery, helping to impart fruity notes and extend aroma during evaporation; in cosmetics and personal care it can be used as a solvent or carrier for active ingredients and fragrance; in the flavor and food-adjacent space it may be considered as an aroma ester under appropriate regulations; in coatings, inks, and adhesives it serves as a solvent or processing aid; and the alkene functionality allows it to be evaluated as a reactive intermediate or plasticizer in certain polymer or plastics formulations; use is subject to local regulations and formulation limits.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	2312.91
methanol	2384.54
isopropanol	2195.45
water	0.47
ethyl acetate	2024.97
n-propanol	1988.03
acetone	3542.75
n-butanol	2112.12
acetonitrile	2042.21
DMF	3171.97
toluene	1234.53
isobutanol	1777.95
1,4-dioxane	2509.13
methyl acetate	1551.12
THF	3937.95
2-butanone	2283.42
n-pentanol	1535.45
sec-butanol	2126.46
n-hexane	1469.54
ethylene glycol	279.92
NMP	3050.24
cyclohexane	1275.99
DMSO	3255.84
n-butyl acetate	1792.31
n-octanol	927.9
chloroform	5246.41
n-propyl acetate	1271.22
acetic acid	2158.71
dichloromethane	4352.71
cyclohexanone	3646.44
propylene glycol	557.62
isopropyl acetate	1343.91
DMAc	2406.26
2-ethoxyethanol	1138.29
isopentanol	1859.36
n-heptane	420.77
ethyl formate	960.41
1,2-dichloroethane	2729.99
n-hexanol	1834.11
2-methoxyethanol	1799.28
isobutyl acetate	826.86
tetrachloromethane	820.11
n-pentyl acetate	1093.63
transcutol	4226.57
n-heptanol	622.26
ethylbenzene	738.9
MIBK	1284.71
2-propoxyethanol	1797.54
tert-butanol	2784.95
MTBE	2594.53
2-butoxyethanol	843.04
propionic acid	1555.73
o-xylene	744.17
formic acid	378.18
diethyl ether	2822.09
m-xylene	854.87
p-xylene	906.94
chlorobenzene	1572.85
dimethyl carbonate	510.91
n-octane	156.6
formamide	495.44
cyclopentanone	3156.57
2-pentanone	2328.16
anisole	1050.13
cyclopentyl methyl ether	2466.07
gamma-butyrolactone	2994.85
1-methoxy-2-propanol	1745.35
pyridine	2202.26
3-pentanone	1560.75
furfural	1941.66
n-dodecane	112.16
diethylene glycol	898.66
diisopropyl ether	874.79
tert-amyl alcohol	2343.83
acetylacetone	1858.61
n-hexadecane	129.64
acetophenone	977.21
methyl propionate	1435.3
isopentyl acetate	1572.3
trichloroethylene	4343.2
n-nonanol	746.36
cyclohexanol	2371.19
benzyl alcohol	855.67
2-ethylhexanol	1110.44
isooctanol	554.3
dipropyl ether	1303.73
1,2-dichlorobenzene	1324.63
ethyl lactate	476.44
propylene carbonate	1663.72
n-methylformamide	1235.56
2-pentanol	1727.41
n-pentane	793.41
1-propoxy-2-propanol	1494.02
1-methoxy-2-propyl acetate	1221.78
2-(2-methoxypropoxy) propanol	1001.46
mesitylene	581.58
ε-caprolactone	2549.14
p-cymene	408.48
epichlorohydrin	2928.49
1,1,1-trichloroethane	2892.44
2-aminoethanol	702.32
morpholine-4-carbaldehyde	2059.14
sulfolane	3804.72
2,2,4-trimethylpentane	299.73
2-methyltetrahydrofuran	3541.68
n-hexyl acetate	1824.8
isooctane	215.28
2-(2-butoxyethoxy)ethanol	1369.9
sec-butyl acetate	899.86
tert-butyl acetate	1457.67
decalin	464.35
glycerin	630.58
diglyme	2048.03
acrylic acid	1157.6
isopropyl myristate	619.38
n-butyric acid	2242.54
acetyl acetate	1085.28
di(2-ethylhexyl) phthalate	525.67
ethyl propionate	1100.1
nitromethane	2657.78
1,2-diethoxyethane	1707.93
benzonitrile	1319.5
trioctyl phosphate	396.5
1-bromopropane	2430.61
gamma-valerolactone	2949.01
n-decanol	519.72
triethyl phosphate	452.71
4-methyl-2-pentanol	840.73
propionitrile	1677.1
vinylene carbonate	1392.9
1,1,2-trichlorotrifluoroethane	1893.51
DMS	950.18
cumene	492.61
2-octanol	575.62
2-hexanone	1620.2
octyl acetate	795.76
limonene	813.76
1,2-dimethoxyethane	2225.84
ethyl orthosilicate	468.28
tributyl phosphate	554.15
diacetone alcohol	1328.02
N,N-dimethylaniline	774.45
acrylonitrile	1649.31
aniline	1258.52
1,3-propanediol	1001.9
bromobenzene	1928.17
dibromomethane	3473.23
1,1,2,2-tetrachloroethane	4046.72
2-methyl-cyclohexyl acetate	903.79
tetrabutyl urea	707.07
diisobutyl methanol	534.91
2-phenylethanol	863.13
styrene	928.23
dioctyl adipate	848.22
dimethyl sulfate	899.26
ethyl butyrate	1020.95
methyl lactate	616.19
butyl lactate	762.31
diethyl carbonate	639.32
propanediol butyl ether	1064.06
triethyl orthoformate	677.74
p-tert-butyltoluene	406.84
methyl 4-tert-butylbenzoate	851.49
morpholine	3154.64
tert-butylamine	2043.43
n-dodecanol	388.2
dimethoxymethane	1559.49
ethylene carbonate	1190.02
cyrene	774.64
2-ethoxyethyl acetate	1131.58
2-ethylhexyl acetate	1208.84
1,2,4-trichlorobenzene	1440.17
4-methylpyridine	2547.89
dibutyl ether	1487.85
2,6-dimethyl-4-heptanol	534.91
DEF	2154.78
dimethyl isosorbide	1442.71
tetrachloroethylene	2382.65
eugenol	751.3
triacetin	1243.69
span 80	1041.51
1,4-butanediol	481.68
1,1-dichloroethane	3293.38
2-methyl-1-pentanol	1421.12
methyl formate	841.65
2-methyl-1-butanol	1817.27
n-decane	208.38
butyronitrile	2213.44
3,7-dimethyl-1-octanol	927.62
1-chlorooctane	807.05
1-chlorotetradecane	274.58
n-nonane	231.92
undecane	144.93
tert-butylcyclohexane	427.95
cyclooctane	353.58
cyclopentanol	2133.0
tetrahydropyran	3925.93
tert-amyl methyl ether	1836.86
2,5,8-trioxanonane	1405.04
1-hexene	2527.73
2-isopropoxyethanol	962.5
2,2,2-trifluoroethanol	505.76
methyl butyrate	1491.03

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