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

Trái cây	80.24%
Hoa hồng	75.02%
Hoa	71.32%
Ngọt	55.35%
Táo	49.0%
Thảo mộc	46.83%
Sáp	39.5%
Rượu vang	39.33%
Cam chanh	38.03%
Nhiệt đới	37.77%

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pKa ước lượng
8.45 (kiềm yếu)

Áp suất hơi ước lượng

• hPa @ 20°C
• hPa @ 25°C

Tốc độ bay hơi
Cực chậm

Nhiệt độ sôi ước lượng
290°C

Nhiệt độ chớp cháy ước lượng
127.35 ˚C

Dung môi	Độ tan (g/L)
ethanol	664.08
methanol	456.94
isopropanol	526.26
water	0.1
ethyl acetate	598.12
n-propanol	452.38
acetone	399.3
n-butanol	530.63
acetonitrile	240.11
DMF	316.58
toluene	388.68
isobutanol	334.3
1,4-dioxane	1036.25
methyl acetate	356.63
THF	1291.67
2-butanone	468.81
n-pentanol	446.22
sec-butanol	534.13
n-hexane	124.64
ethylene glycol	23.98
NMP	324.36
cyclohexane	187.5
DMSO	315.13
n-butyl acetate	562.86
n-octanol	225.65
chloroform	1274.42
n-propyl acetate	406.78
acetic acid	267.79
dichloromethane	980.17
cyclohexanone	643.49
propylene glycol	100.95
isopropyl acetate	425.1
DMAc	496.85
2-ethoxyethanol	443.54
isopentanol	525.87
n-heptane	66.36
ethyl formate	209.13
1,2-dichloroethane	624.05
n-hexanol	555.3
2-methoxyethanol	529.63
isobutyl acetate	303.7
tetrachloromethane	162.42
n-pentyl acetate	318.16
transcutol	1770.15
n-heptanol	227.68
ethylbenzene	260.47
MIBK	330.36
2-propoxyethanol	660.72
tert-butanol	678.59
MTBE	755.14
2-butoxyethanol	379.99
propionic acid	190.81
o-xylene	231.2
formic acid	50.02
diethyl ether	676.49
m-xylene	269.2
p-xylene	330.67
chlorobenzene	359.84
dimethyl carbonate	74.13
n-octane	28.43
formamide	74.88
cyclopentanone	470.77
2-pentanone	426.47
anisole	398.84
cyclopentyl methyl ether	534.99
gamma-butyrolactone	406.72
1-methoxy-2-propanol	494.43
pyridine	635.31
3-pentanone	279.41
furfural	392.34
n-dodecane	21.14
diethylene glycol	244.53
diisopropyl ether	215.3
tert-amyl alcohol	626.28
acetylacetone	395.98
n-hexadecane	24.88
acetophenone	316.07
methyl propionate	261.22
isopentyl acetate	555.0
trichloroethylene	1033.24
n-nonanol	213.14
cyclohexanol	474.68
benzyl alcohol	290.6
2-ethylhexanol	349.21
isooctanol	195.03
dipropyl ether	380.85
1,2-dichlorobenzene	322.96
ethyl lactate	154.67
propylene carbonate	308.79
n-methylformamide	121.56
2-pentanol	433.64
n-pentane	83.66
1-propoxy-2-propanol	558.54
1-methoxy-2-propyl acetate	481.03
2-(2-methoxypropoxy) propanol	424.47
mesitylene	172.74
ε-caprolactone	564.98
p-cymene	158.26
epichlorohydrin	749.69
1,1,1-trichloroethane	626.4
2-aminoethanol	116.85
morpholine-4-carbaldehyde	502.24
sulfolane	387.35
2,2,4-trimethylpentane	58.45
2-methyltetrahydrofuran	1017.27
n-hexyl acetate	457.52
isooctane	44.26
2-(2-butoxyethoxy)ethanol	591.72
sec-butyl acetate	366.06
tert-butyl acetate	442.1
decalin	99.93
glycerin	99.85
diglyme	929.36
acrylic acid	113.32
isopropyl myristate	189.06
n-butyric acid	467.98
acetyl acetate	290.07
di(2-ethylhexyl) phthalate	179.69
ethyl propionate	318.27
nitromethane	293.57
1,2-diethoxyethane	712.21
benzonitrile	323.45
trioctyl phosphate	115.06
1-bromopropane	489.22
gamma-valerolactone	689.51
n-decanol	156.21
triethyl phosphate	163.76
4-methyl-2-pentanol	265.99
propionitrile	250.88
vinylene carbonate	247.09
1,1,2-trichlorotrifluoroethane	386.02
DMS	236.57
cumene	178.26
2-octanol	166.09
2-hexanone	427.95
octyl acetate	230.38
limonene	243.27
1,2-dimethoxyethane	796.47
ethyl orthosilicate	182.97
tributyl phosphate	150.23
diacetone alcohol	428.19
N,N-dimethylaniline	269.6
acrylonitrile	203.57
aniline	331.51
1,3-propanediol	265.82
bromobenzene	405.07
dibromomethane	721.51
1,1,2,2-tetrachloroethane	998.77
2-methyl-cyclohexyl acetate	354.41
tetrabutyl urea	180.65
diisobutyl methanol	191.56
2-phenylethanol	345.82
styrene	287.63
dioctyl adipate	270.48
dimethyl sulfate	92.23
ethyl butyrate	392.87
methyl lactate	111.36
butyl lactate	238.57
diethyl carbonate	235.98
propanediol butyl ether	319.86
triethyl orthoformate	288.83
p-tert-butyltoluene	153.09
methyl 4-tert-butylbenzoate	299.73
morpholine	1261.84
tert-butylamine	474.82
n-dodecanol	115.66
dimethoxymethane	326.79
ethylene carbonate	236.91
cyrene	269.0
2-ethoxyethyl acetate	434.44
2-ethylhexyl acetate	443.08
1,2,4-trichlorobenzene	385.68
4-methylpyridine	674.89
dibutyl ether	348.59
2,6-dimethyl-4-heptanol	191.56
DEF	383.68
dimethyl isosorbide	612.65
tetrachloroethylene	542.72
eugenol	295.38
triacetin	358.35
span 80	395.28
1,4-butanediol	102.82
1,1-dichloroethane	660.88
2-methyl-1-pentanol	452.22
methyl formate	75.53
2-methyl-1-butanol	433.5
n-decane	39.78
butyronitrile	395.78
3,7-dimethyl-1-octanol	270.85
1-chlorooctane	167.82
1-chlorotetradecane	65.15
n-nonane	37.79
undecane	27.96
tert-butylcyclohexane	93.91
cyclooctane	58.23
cyclopentanol	300.3
tetrahydropyran	1276.77
tert-amyl methyl ether	520.22
2,5,8-trioxanonane	617.4
1-hexene	396.59
2-isopropoxyethanol	370.5
2,2,2-trifluoroethanol	54.81
methyl butyrate	421.98

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