Molecular formula
C15H26O2

SMILES
CC(C)CC(=O)OCCC(=CCC=C(C)C)C

Fragrance
Fruity	83.0%
Rose	67.35%
Green	64.05%
Apple	62.42%
Floral	61.42%
Sweet	58.5%
Tropical	54.29%
Herbal	52.6%
Citrus	49.11%
Pineapple	43.35%

 

Flavor
Fruity	60.85%
Rose	57.14%
Green	56.57%
Sweet	55.45%
Bitter	51.7%
Floral	44.32%
Tropical	42.1%
Geranium	39.41%
Waxy	39.21%
Apple	37.23%

 

Odor impact est.
Medium

XLogP3-AA
4.9

pKa est.
8.44 (weak base)

Molecular weight
238.37 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Ultra slow

Boiling point est.
275°C

Flash point

• 118.07 ˚C est.

• NS00012500

3,7-Dimethylocta-3,6-dienyl 3-methylbutanoate is a terpene-derived ester commonly regarded as a fragrance ingredient with aroma characteristics. In perfumery/fragrance and cosmetics/personal care, it serves as a scent component or a fixative in perfumes and personal care products; in household products and cleaning formulations, it contributes a pleasant odor; in food processing and flavor applications, it may be considered for aroma formulations where permitted; in coatings/inks and polymers/plastics, it can be evaluated as an aroma additive or scent modifier in resin and coating systems.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	891.52
methanol	713.37
isopropanol	890.66
water	0.26
ethyl acetate	796.84
n-propanol	703.7
acetone	924.89
n-butanol	827.56
acetonitrile	503.96
DMF	649.57
toluene	486.25
isobutanol	619.39
1,4-dioxane	1429.59
methyl acetate	545.35
THF	1971.06
2-butanone	749.01
n-pentanol	611.83
sec-butanol	894.01
n-hexane	364.18
ethylene glycol	45.4
NMP	767.12
cyclohexane	484.4
DMSO	615.59
n-butyl acetate	739.56
n-octanol	429.01
chloroform	2424.6
n-propyl acetate	548.37
acetic acid	612.72
dichloromethane	1687.1
cyclohexanone	1314.02
propylene glycol	204.62
isopropyl acetate	568.03
DMAc	716.85
2-ethoxyethanol	496.85
isopentanol	785.42
n-heptane	164.26
ethyl formate	373.11
1,2-dichloroethane	959.07
n-hexanol	809.88
2-methoxyethanol	705.79
isobutyl acetate	422.22
tetrachloromethane	315.91
n-pentyl acetate	496.48
transcutol	2094.91
n-heptanol	367.99
ethylbenzene	349.7
MIBK	496.49
2-propoxyethanol	795.97
tert-butanol	1222.56
MTBE	1034.6
2-butoxyethanol	502.42
propionic acid	442.37
o-xylene	332.07
formic acid	97.27
diethyl ether	844.34
m-xylene	385.69
p-xylene	478.68
chlorobenzene	608.66
dimethyl carbonate	143.5
n-octane	68.93
formamide	124.66
cyclopentanone	1065.31
2-pentanone	711.97
anisole	508.13
cyclopentyl methyl ether	914.1
gamma-butyrolactone	941.06
1-methoxy-2-propanol	679.63
pyridine	894.47
3-pentanone	479.65
furfural	764.36
n-dodecane	48.56
diethylene glycol	346.99
diisopropyl ether	335.77
tert-amyl alcohol	1051.49
acetylacetone	646.29
n-hexadecane	55.93
acetophenone	463.34
methyl propionate	426.61
isopentyl acetate	699.44
trichloroethylene	1770.93
n-nonanol	380.28
cyclohexanol	961.45
benzyl alcohol	417.46
2-ethylhexanol	507.3
isooctanol	316.08
dipropyl ether	537.94
1,2-dichlorobenzene	550.57
ethyl lactate	246.64
propylene carbonate	671.01
n-methylformamide	236.92
2-pentanol	717.03
n-pentane	209.01
1-propoxy-2-propanol	729.63
1-methoxy-2-propyl acetate	594.48
2-(2-methoxypropoxy) propanol	571.42
mesitylene	264.77
ε-caprolactone	1044.15
p-cymene	237.26
epichlorohydrin	1258.25
1,1,1-trichloroethane	1193.19
2-aminoethanol	194.61
morpholine-4-carbaldehyde	829.87
sulfolane	937.88
2,2,4-trimethylpentane	116.76
2-methyltetrahydrofuran	1567.38
n-hexyl acetate	773.38
isooctane	92.86
2-(2-butoxyethoxy)ethanol	745.89
sec-butyl acetate	439.55
tert-butyl acetate	635.33
decalin	186.81
glycerin	193.87
diglyme	1079.83
acrylic acid	273.63
isopropyl myristate	314.91
n-butyric acid	894.02
acetyl acetate	443.71
di(2-ethylhexyl) phthalate	273.16
ethyl propionate	439.94
nitromethane	616.51
1,2-diethoxyethane	761.28
benzonitrile	526.19
trioctyl phosphate	203.98
1-bromopropane	777.13
gamma-valerolactone	1222.88
n-decanol	275.06
triethyl phosphate	241.61
4-methyl-2-pentanol	410.3
propionitrile	452.0
vinylene carbonate	523.25
1,1,2-trichlorotrifluoroethane	720.58
DMS	405.73
cumene	258.73
2-octanol	313.3
2-hexanone	621.07
octyl acetate	389.51
limonene	389.1
1,2-dimethoxyethane	964.04
ethyl orthosilicate	253.41
tributyl phosphate	261.32
diacetone alcohol	610.38
N,N-dimethylaniline	352.16
acrylonitrile	364.01
aniline	503.73
1,3-propanediol	403.29
bromobenzene	662.99
dibromomethane	1297.65
1,1,2,2-tetrachloroethane	1759.31
2-methyl-cyclohexyl acetate	492.58
tetrabutyl urea	314.24
diisobutyl methanol	297.2
2-phenylethanol	479.36
styrene	393.21
dioctyl adipate	421.73
dimethyl sulfate	197.85
ethyl butyrate	508.75
methyl lactate	213.06
butyl lactate	385.23
diethyl carbonate	334.44
propanediol butyl ether	545.53
triethyl orthoformate	383.39
p-tert-butyltoluene	223.89
methyl 4-tert-butylbenzoate	464.91
morpholine	1709.29
tert-butylamine	838.43
n-dodecanol	210.12
dimethoxymethane	485.67
ethylene carbonate	494.5
cyrene	431.64
2-ethoxyethyl acetate	544.1
2-ethylhexyl acetate	550.62
1,2,4-trichlorobenzene	661.37
4-methylpyridine	990.18
dibutyl ether	591.03
2,6-dimethyl-4-heptanol	297.2
DEF	606.23
dimethyl isosorbide	828.58
tetrachloroethylene	944.2
eugenol	418.78
triacetin	589.17
span 80	606.47
1,4-butanediol	164.67
1,1-dichloroethane	1231.01
2-methyl-1-pentanol	621.42
methyl formate	187.58
2-methyl-1-butanol	700.99
n-decane	89.95
butyronitrile	702.13
3,7-dimethyl-1-octanol	437.87
1-chlorooctane	324.86
1-chlorotetradecane	130.87
n-nonane	95.02
undecane	63.04
tert-butylcyclohexane	173.99
cyclooctane	140.69
cyclopentanol	746.91
tetrahydropyran	1834.63
tert-amyl methyl ether	692.49
2,5,8-trioxanonane	763.74
1-hexene	723.57
2-isopropoxyethanol	439.5
2,2,2-trifluoroethanol	146.29
methyl butyrate	608.75

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