Molecular formula
C11H18O2

SMILES
CC/C=C/C/C=C/CCOC(=O)C

Fragrance
Green	85.57%
Fruity	71.56%
Melon	64.94%
Fatty	63.45%
Pear	61.53%
Fresh	54.93%
Tropical	53.97%
Waxy	52.3%
Sweet	51.75%
Apple	47.93%

 

Flavor
Green	45.92%
Fresh	38.51%
Melon	35.1%
Waxy	29.49%
Tropical	28.83%
Fatty	27.75%
Floral	27.28%
Oily	26.99%
Sweet	26.05%
Cucumber	25.64%

 

Odor impact est.
High

XLogP3-AA
2.8

pKa est.
8.31 (weak base)

Molecular weight
182.26 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Moderately slow

Boiling point est.
226°C

Flash point

• 110.05 ˚C est.

• 3,6-Nonadienyl acetate
• EINECS 278-519-9
• 3,6-Nonadien-1-ol,1-acetate
• (2E,6Z)-3,6-Nonadien-1-ol acetate
• 3-6-Nonadien-1-yl-acetate
• SCHEMBL3503284
• (e,e)-3,6-nonadienyl acetate
• SCHEMBL18339325
• CMNKZQXSZSHGNF-AOSYACOCSA-N
• AKOS006274303

3,6-Nonadienyl acetate is used primarily as an intermediate in fragrance synthesis and as a fragrance component (odorant) in perfumery. In cosmetics and personal care, it may serve as a fragrance ingredient or carrier. It also functions as a processing aid or solvent in coatings and inks, helping dissolve or disperse formulation components. In polymer and plastics chemistry, it can act as a monomer precursor or plasticizer for certain resin systems. It may also be used in household and cleaning products as a solvent or carrier for formulations, subject to local regulations and formulation limits.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	781.43
methanol	839.31
isopropanol	505.88
water	0.15
ethyl acetate	426.13
n-propanol	520.47
acetone	618.03
n-butanol	466.7
acetonitrile	398.93
DMF	713.71
toluene	253.51
isobutanol	327.54
1,4-dioxane	857.0
methyl acetate	350.85
THF	1148.19
2-butanone	487.03
n-pentanol	398.91
sec-butanol	446.68
n-hexane	142.81
ethylene glycol	99.15
NMP	582.47
cyclohexane	138.41
DMSO	1179.91
n-butyl acetate	342.0
n-octanol	124.0
chloroform	1165.43
n-propyl acetate	280.71
acetic acid	438.53
dichloromethane	1022.61
cyclohexanone	655.88
propylene glycol	211.21
isopropyl acetate	272.71
DMAc	709.48
2-ethoxyethanol	534.81
isopentanol	368.75
n-heptane	43.77
ethyl formate	180.14
1,2-dichloroethane	663.51
n-hexanol	345.28
2-methoxyethanol	726.38
isobutyl acetate	195.83
tetrachloromethane	139.61
n-pentyl acetate	173.58
transcutol	1836.91
n-heptanol	102.46
ethylbenzene	141.14
MIBK	249.44
2-propoxyethanol	529.66
tert-butanol	639.34
MTBE	552.18
2-butoxyethanol	219.85
propionic acid	307.34
o-xylene	147.48
formic acid	117.45
diethyl ether	654.44
m-xylene	160.99
p-xylene	160.99
chlorobenzene	279.27
dimethyl carbonate	101.03
n-octane	13.98
formamide	163.41
cyclopentanone	644.0
2-pentanone	423.08
anisole	292.38
cyclopentyl methyl ether	561.73
gamma-butyrolactone	556.91
1-methoxy-2-propanol	532.16
pyridine	641.67
3-pentanone	301.67
furfural	452.11
n-dodecane	12.02
diethylene glycol	338.77
diisopropyl ether	147.68
tert-amyl alcohol	503.56
acetylacetone	405.07
n-hexadecane	13.85
acetophenone	246.53
methyl propionate	297.03
isopentyl acetate	311.66
trichloroethylene	970.74
n-nonanol	112.59
cyclohexanol	434.87
benzyl alcohol	238.23
2-ethylhexanol	201.11
isooctanol	90.04
dipropyl ether	261.44
1,2-dichlorobenzene	245.66
ethyl lactate	131.76
propylene carbonate	281.06
n-methylformamide	256.14
2-pentanol	315.86
n-pentane	76.8
1-propoxy-2-propanol	375.13
1-methoxy-2-propyl acetate	321.49
2-(2-methoxypropoxy) propanol	325.24
mesitylene	106.45
ε-caprolactone	504.98
p-cymene	79.25
epichlorohydrin	762.53
1,1,1-trichloroethane	516.42
2-aminoethanol	269.6
morpholine-4-carbaldehyde	581.57
sulfolane	761.53
2,2,4-trimethylpentane	41.38
2-methyltetrahydrofuran	873.52
n-hexyl acetate	270.56
isooctane	28.43
2-(2-butoxyethoxy)ethanol	420.68
sec-butyl acetate	211.77
tert-butyl acetate	330.89
decalin	70.43
glycerin	231.25
diglyme	694.02
acrylic acid	221.06
isopropyl myristate	106.89
n-butyric acid	439.02
acetyl acetate	237.9
di(2-ethylhexyl) phthalate	113.99
ethyl propionate	245.87
nitromethane	549.16
1,2-diethoxyethane	531.4
benzonitrile	259.08
trioctyl phosphate	70.66
1-bromopropane	520.1
gamma-valerolactone	666.94
n-decanol	80.94
triethyl phosphate	123.72
4-methyl-2-pentanol	167.47
propionitrile	330.93
vinylene carbonate	231.26
1,1,2-trichlorotrifluoroethane	557.41
DMS	223.26
cumene	95.02
2-octanol	75.29
2-hexanone	337.43
octyl acetate	129.96
limonene	141.11
1,2-dimethoxyethane	736.52
ethyl orthosilicate	129.87
tributyl phosphate	108.94
diacetone alcohol	339.67
N,N-dimethylaniline	211.82
acrylonitrile	325.56
aniline	321.02
1,3-propanediol	352.9
bromobenzene	327.51
dibromomethane	757.29
1,1,2,2-tetrachloroethane	948.1
2-methyl-cyclohexyl acetate	219.2
tetrabutyl urea	141.48
diisobutyl methanol	106.9
2-phenylethanol	219.79
styrene	195.51
dioctyl adipate	183.99
dimethyl sulfate	195.54
ethyl butyrate	235.17
methyl lactate	154.85
butyl lactate	152.33
diethyl carbonate	155.31
propanediol butyl ether	257.0
triethyl orthoformate	180.14
p-tert-butyltoluene	79.38
methyl 4-tert-butylbenzoate	202.67
morpholine	1130.44
tert-butylamine	406.14
n-dodecanol	61.83
dimethoxymethane	445.88
ethylene carbonate	199.59
cyrene	253.07
2-ethoxyethyl acetate	269.15
2-ethylhexyl acetate	247.83
1,2,4-trichlorobenzene	302.72
4-methylpyridine	552.86
dibutyl ether	231.06
2,6-dimethyl-4-heptanol	106.9
DEF	455.46
dimethyl isosorbide	450.11
tetrachloroethylene	536.42
eugenol	206.64
triacetin	286.85
span 80	271.27
1,4-butanediol	153.46
1,1-dichloroethane	600.34
2-methyl-1-pentanol	343.63
methyl formate	147.92
2-methyl-1-butanol	365.71
n-decane	20.7
butyronitrile	367.47
3,7-dimethyl-1-octanol	142.12
1-chlorooctane	94.44
1-chlorotetradecane	39.07
n-nonane	20.47
undecane	15.11
tert-butylcyclohexane	61.14
cyclooctane	37.82
cyclopentanol	388.31
tetrahydropyran	983.25
tert-amyl methyl ether	397.1
2,5,8-trioxanonane	541.26
1-hexene	391.71
2-isopropoxyethanol	368.89
2,2,2-trifluoroethanol	94.37
methyl butyrate	304.9

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