SMILES
C\C=C/CCCC(O)=O

Xanh	85.03%
Trái cây	80.04%
Béo	69.07%
Sáp	60.01%
Sữa	52.32%
Phô mai	51.18%
Dưa	40.52%
Dầu	37.56%
Rau củ	34.87%
Chua	32.07%

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pKa ước lượng
8.44 (kiềm yếu)

Áp suất hơi ước lượng

• hPa @ 20°C
• hPa @ 25°C

Tốc độ bay hơi
Chậm

Nhiệt độ sôi ước lượng
228°C

Nhiệt độ chớp cháy ước lượng
102.59 ˚C

Dung môi	Độ tan (g/L)
ethanol	431.79
methanol	747.07
isopropanol	208.8
water	20.7
ethyl acetate	101.72
n-propanol	285.45
acetone	335.55
n-butanol	224.84
acetonitrile	65.86
DMF	948.54
toluene	26.79
isobutanol	213.33
1,4-dioxane	143.24
methyl acetate	101.47
THF	527.14
2-butanone	181.47
n-pentanol	193.22
sec-butanol	193.75
n-hexane	31.29
ethylene glycol	293.96
NMP	1094.36
cyclohexane	10.38
DMSO	1568.43
n-butyl acetate	166.74
n-octanol	95.68
chloroform	61.12
n-propyl acetate	115.93
acetic acid	462.06
dichloromethane	63.52
cyclohexanone	316.46
propylene glycol	325.08
isopropyl acetate	92.2
DMAc	593.99
2-ethoxyethanol	319.15
isopentanol	232.81
n-heptane	11.29
ethyl formate	106.44
1,2-dichloroethane	88.32
n-hexanol	208.42
2-methoxyethanol	523.68
isobutyl acetate	78.33
tetrachloromethane	31.89
n-pentyl acetate	97.64
transcutol	1224.72
n-heptanol	87.77
ethylbenzene	30.74
MIBK	149.16
2-propoxyethanol	345.58
tert-butanol	382.09
MTBE	156.12
2-butoxyethanol	190.84
propionic acid	329.18
o-xylene	42.23
formic acid	382.21
diethyl ether	63.72
m-xylene	42.9
p-xylene	39.16
chlorobenzene	50.68
dimethyl carbonate	91.19
n-octane	3.92
formamide	418.79
cyclopentanone	591.04
2-pentanone	190.66
anisole	103.54
cyclopentyl methyl ether	248.07
gamma-butyrolactone	600.21
1-methoxy-2-propanol	418.37
pyridine	106.73
3-pentanone	113.49
furfural	413.15
n-dodecane	2.94
diethylene glycol	341.76
diisopropyl ether	43.37
tert-amyl alcohol	353.06
acetylacetone	234.18
n-hexadecane	3.25
acetophenone	132.77
methyl propionate	136.26
isopentyl acetate	163.88
trichloroethylene	171.57
n-nonanol	76.57
cyclohexanol	188.58
benzyl alcohol	120.96
2-ethylhexanol	114.66
isooctanol	73.83
dipropyl ether	71.01
1,2-dichlorobenzene	71.76
ethyl lactate	102.89
propylene carbonate	269.68
n-methylformamide	433.9
2-pentanol	144.72
n-pentane	12.26
1-propoxy-2-propanol	254.83
1-methoxy-2-propyl acetate	194.33
2-(2-methoxypropoxy) propanol	254.29
mesitylene	37.18
ε-caprolactone	291.96
p-cymene	31.84
epichlorohydrin	356.06
1,1,1-trichloroethane	77.88
2-aminoethanol	464.97
morpholine-4-carbaldehyde	520.17
sulfolane	1157.17
2,2,4-trimethylpentane	17.08
2-methyltetrahydrofuran	354.92
n-hexyl acetate	164.11
isooctane	13.33
2-(2-butoxyethoxy)ethanol	351.98
sec-butyl acetate	78.06
tert-butyl acetate	163.41
decalin	15.17
glycerin	446.66
diglyme	437.08
acrylic acid	329.27
isopropyl myristate	52.45
n-butyric acid	300.43
acetyl acetate	74.1
di(2-ethylhexyl) phthalate	82.12
ethyl propionate	95.82
nitromethane	462.41
1,2-diethoxyethane	149.38
benzonitrile	88.21
trioctyl phosphate	58.68
1-bromopropane	35.06
gamma-valerolactone	541.95
n-decanol	55.68
triethyl phosphate	64.87
4-methyl-2-pentanol	113.3
propionitrile	77.44
vinylene carbonate	177.68
1,1,2-trichlorotrifluoroethane	409.59
DMS	130.9
cumene	34.73
2-octanol	57.89
2-hexanone	170.42
octyl acetate	75.48
limonene	52.0
1,2-dimethoxyethane	321.0
ethyl orthosilicate	61.87
tributyl phosphate	80.85
diacetone alcohol	335.81
N,N-dimethylaniline	104.4
acrylonitrile	110.31
aniline	100.63
1,3-propanediol	381.89
bromobenzene	39.37
dibromomethane	45.73
1,1,2,2-tetrachloroethane	170.53
2-methyl-cyclohexyl acetate	109.82
tetrabutyl urea	107.78
diisobutyl methanol	64.88
2-phenylethanol	130.02
styrene	31.28
dioctyl adipate	101.5
dimethyl sulfate	288.2
ethyl butyrate	95.88
methyl lactate	185.66
butyl lactate	146.18
diethyl carbonate	64.5
propanediol butyl ether	318.18
triethyl orthoformate	78.24
p-tert-butyltoluene	32.75
methyl 4-tert-butylbenzoate	145.88
morpholine	256.93
tert-butylamine	207.3
n-dodecanol	38.42
dimethoxymethane	250.46
ethylene carbonate	137.06
cyrene	240.35
2-ethoxyethyl acetate	152.66
2-ethylhexyl acetate	118.0
1,2,4-trichlorobenzene	99.52
4-methylpyridine	123.77
dibutyl ether	64.19
2,6-dimethyl-4-heptanol	64.88
DEF	256.28
dimethyl isosorbide	337.89
tetrachloroethylene	138.85
eugenol	158.06
triacetin	164.76
span 80	212.55
1,4-butanediol	189.58
1,1-dichloroethane	54.51
2-methyl-1-pentanol	203.29
methyl formate	240.05
2-methyl-1-butanol	233.34
n-decane	5.26
butyronitrile	81.9
3,7-dimethyl-1-octanol	105.16
1-chlorooctane	30.37
1-chlorotetradecane	10.68
n-nonane	5.3
undecane	3.8
tert-butylcyclohexane	19.81
cyclooctane	5.58
cyclopentanol	307.25
tetrahydropyran	124.16
tert-amyl methyl ether	152.15
2,5,8-trioxanonane	331.31
1-hexene	66.77
2-isopropoxyethanol	222.01
2,2,2-trifluoroethanol	172.88
methyl butyrate	146.33

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