SMILES
CCC(C)CC(=O)OC\C=C(/C)CCC=C(C)C

Trái cây	79.95%
Hoa hồng	72.54%
Hoa	69.26%
Táo	51.96%
Ngọt	47.66%
Thảo mộc	46.73%
Nhiệt đới	42.24%
Cam chanh	40.04%
Phong lữ	39.99%
Sáp	38.78%

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pKa ước lượng
8.41 (kiềm yếu)

Áp suất hơi ước lượng

• hPa @ 20°C
• hPa @ 25°C

Tốc độ bay hơi
Cực chậm

Nhiệt độ sôi ước lượng
288°C

Nhiệt độ chớp cháy ước lượng
125.11 ˚C

Dung môi	Độ tan (g/L)
ethanol	1111.69
methanol	752.35
isopropanol	976.99
water	0.11
ethyl acetate	998.55
n-propanol	801.27
acetone	870.74
n-butanol	901.05
acetonitrile	481.88
DMF	593.39
toluene	557.15
isobutanol	626.13
1,4-dioxane	1796.35
methyl acetate	605.82
THF	2183.3
2-butanone	900.93
n-pentanol	674.95
sec-butanol	952.7
n-hexane	229.97
ethylene glycol	34.72
NMP	606.5
cyclohexane	403.08
DMSO	601.85
n-butyl acetate	845.32
n-octanol	347.64
chloroform	2088.67
n-propyl acetate	634.4
acetic acid	441.36
dichloromethane	1635.34
cyclohexanone	1291.91
propylene glycol	165.8
isopropyl acetate	675.64
DMAc	712.41
2-ethoxyethanol	602.07
isopentanol	855.66
n-heptane	105.63
ethyl formate	359.99
1,2-dichloroethane	1055.69
n-hexanol	837.75
2-methoxyethanol	821.54
isobutyl acetate	445.35
tetrachloromethane	270.4
n-pentyl acetate	501.94
transcutol	2655.37
n-heptanol	337.55
ethylbenzene	350.63
MIBK	527.94
2-propoxyethanol	885.41
tert-butanol	1244.6
MTBE	1265.65
2-butoxyethanol	522.11
propionic acid	359.52
o-xylene	347.47
formic acid	74.45
diethyl ether	1137.36
m-xylene	395.16
p-xylene	472.81
chlorobenzene	601.51
dimethyl carbonate	124.6
n-octane	45.54
formamide	117.31
cyclopentanone	966.33
2-pentanone	779.39
anisole	555.24
cyclopentyl methyl ether	937.83
gamma-butyrolactone	794.04
1-methoxy-2-propanol	770.01
pyridine	1106.57
3-pentanone	501.7
furfural	666.67
n-dodecane	32.46
diethylene glycol	346.92
diisopropyl ether	365.22
tert-amyl alcohol	1067.29
acetylacetone	660.13
n-hexadecane	38.77
acetophenone	453.17
methyl propionate	456.56
isopentyl acetate	802.12
trichloroethylene	1709.43
n-nonanol	319.58
cyclohexanol	912.41
benzyl alcohol	411.64
2-ethylhexanol	482.79
isooctanol	283.23
dipropyl ether	554.47
1,2-dichlorobenzene	514.22
ethyl lactate	218.14
propylene carbonate	546.42
n-methylformamide	217.63
2-pentanol	734.19
n-pentane	143.16
1-propoxy-2-propanol	758.48
1-methoxy-2-propyl acetate	675.41
2-(2-methoxypropoxy) propanol	581.03
mesitylene	257.39
ε-caprolactone	991.3
p-cymene	217.28
epichlorohydrin	1304.74
1,1,1-trichloroethane	1131.04
2-aminoethanol	175.72
morpholine-4-carbaldehyde	786.25
sulfolane	760.66
2,2,4-trimethylpentane	90.53
2-methyltetrahydrofuran	1764.61
n-hexyl acetate	724.28
isooctane	70.26
2-(2-butoxyethoxy)ethanol	816.54
sec-butyl acetate	512.92
tert-butyl acetate	695.29
decalin	157.21
glycerin	157.57
diglyme	1283.32
acrylic acid	202.81
isopropyl myristate	287.14
n-butyric acid	840.94
acetyl acetate	466.34
di(2-ethylhexyl) phthalate	247.49
ethyl propionate	499.19
nitromethane	533.04
1,2-diethoxyethane	998.15
benzonitrile	513.74
trioctyl phosphate	167.8
1-bromopropane	797.68
gamma-valerolactone	1199.04
n-decanol	230.79
triethyl phosphate	228.91
4-methyl-2-pentanol	412.21
propionitrile	460.57
vinylene carbonate	425.02
1,1,2-trichlorotrifluoroethane	629.55
DMS	366.31
cumene	245.69
2-octanol	257.67
2-hexanone	658.88
octyl acetate	355.08
limonene	360.52
1,2-dimethoxyethane	1170.71
ethyl orthosilicate	245.71
tributyl phosphate	223.56
diacetone alcohol	640.37
N,N-dimethylaniline	356.86
acrylonitrile	355.81
aniline	546.93
1,3-propanediol	422.79
bromobenzene	674.52
dibromomethane	1230.44
1,1,2,2-tetrachloroethane	1664.8
2-methyl-cyclohexyl acetate	491.06
tetrabutyl urea	270.2
diisobutyl methanol	274.4
2-phenylethanol	489.25
styrene	412.8
dioctyl adipate	385.79
dimethyl sulfate	164.93
ethyl butyrate	566.69
methyl lactate	182.37
butyl lactate	349.78
diethyl carbonate	340.42
propanediol butyl ether	466.06
triethyl orthoformate	396.25
p-tert-butyltoluene	209.12
methyl 4-tert-butylbenzoate	431.59
morpholine	2245.36
tert-butylamine	824.21
n-dodecanol	173.69
dimethoxymethane	543.17
ethylene carbonate	409.8
cyrene	381.9
2-ethoxyethyl acetate	630.09
2-ethylhexyl acetate	623.15
1,2,4-trichlorobenzene	608.29
4-methylpyridine	1135.16
dibutyl ether	548.18
2,6-dimethyl-4-heptanol	274.4
DEF	663.12
dimethyl isosorbide	838.91
tetrachloroethylene	909.63
eugenol	409.67
triacetin	533.4
span 80	577.71
1,4-butanediol	152.06
1,1-dichloroethane	1191.99
2-methyl-1-pentanol	673.41
methyl formate	142.34
2-methyl-1-butanol	732.12
n-decane	61.57
butyronitrile	719.8
3,7-dimethyl-1-octanol	389.52
1-chlorooctane	259.06
1-chlorotetradecane	102.18
n-nonane	60.63
undecane	42.72
tert-butylcyclohexane	138.27
cyclooctane	102.82
cyclopentanol	629.85
tetrahydropyran	2367.01
tert-amyl methyl ether	789.01
2,5,8-trioxanonane	842.28
1-hexene	661.62
2-isopropoxyethanol	506.97
2,2,2-trifluoroethanol	94.45
methyl butyrate	682.14

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