SMILES
CC=CCC(=O)OCCc1ccccc1

Hoa	71.64%
Ngọt	65.47%
Xanh	64.59%
Hoa hồng	60.37%
Nhựa thơm	59.71%
Mật ong	57.59%
Thảo mộc	45.6%
Trái cây	43.36%
Cay	41.77%
Dạ lan hương	37.25%

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pKa ước lượng
7.23 (trung tính)

Áp suất hơi ước lượng

• hPa @ 20°C
• hPa @ 25°C

Tốc độ bay hơi
Cực chậm

Nhiệt độ sôi ước lượng
284°C

Nhiệt độ chớp cháy ước lượng
136.34 ˚C

Dung môi	Độ tan (g/L)
ethanol	390.75
methanol	480.36
isopropanol	182.86
water	0.19
ethyl acetate	392.83
n-propanol	258.65
acetone	360.43
n-butanol	207.74
acetonitrile	378.4
DMF	548.74
toluene	219.45
isobutanol	147.16
1,4-dioxane	774.04
methyl acetate	322.57
THF	540.29
2-butanone	331.85
n-pentanol	171.56
sec-butanol	169.37
n-hexane	21.09
ethylene glycol	63.72
NMP	313.87
cyclohexane	42.12
DMSO	890.06
n-butyl acetate	221.0
n-octanol	50.96
chloroform	1481.63
n-propyl acetate	205.78
acetic acid	318.04
dichloromethane	1445.38
cyclohexanone	404.3
propylene glycol	114.32
isopropyl acetate	171.64
DMAc	596.69
2-ethoxyethanol	295.53
isopentanol	157.71
n-heptane	12.02
ethyl formate	163.56
1,2-dichloroethane	943.27
n-hexanol	164.99
2-methoxyethanol	397.53
isobutyl acetate	124.99
tetrachloromethane	79.37
n-pentyl acetate	93.68
transcutol	1349.77
n-heptanol	54.28
ethylbenzene	108.58
MIBK	144.66
2-propoxyethanol	285.09
tert-butanol	213.29
MTBE	203.68
2-butoxyethanol	132.97
propionic acid	209.55
o-xylene	107.72
formic acid	93.84
diethyl ether	373.04
m-xylene	110.27
p-xylene	120.09
chlorobenzene	308.66
dimethyl carbonate	127.87
n-octane	5.13
formamide	179.55
cyclopentanone	395.84
2-pentanone	230.12
anisole	261.69
cyclopentyl methyl ether	228.0
gamma-butyrolactone	439.2
1-methoxy-2-propanol	277.54
pyridine	622.09
3-pentanone	211.51
furfural	403.63
n-dodecane	5.93
diethylene glycol	220.11
diisopropyl ether	65.28
tert-amyl alcohol	171.89
acetylacetone	304.88
n-hexadecane	6.81
acetophenone	215.17
methyl propionate	266.77
isopentyl acetate	177.6
trichloroethylene	1357.38
n-nonanol	52.54
cyclohexanol	181.7
benzyl alcohol	180.42
2-ethylhexanol	95.13
isooctanol	47.84
dipropyl ether	126.66
1,2-dichlorobenzene	270.17
ethyl lactate	95.2
propylene carbonate	241.15
n-methylformamide	215.7
2-pentanol	122.0
n-pentane	12.75
1-propoxy-2-propanol	184.37
1-methoxy-2-propyl acetate	222.3
2-(2-methoxypropoxy) propanol	199.04
mesitylene	63.33
ε-caprolactone	299.52
p-cymene	51.73
epichlorohydrin	734.86
1,1,1-trichloroethane	471.15
2-aminoethanol	156.21
morpholine-4-carbaldehyde	406.23
sulfolane	512.84
2,2,4-trimethylpentane	11.76
2-methyltetrahydrofuran	333.24
n-hexyl acetate	139.28
isooctane	8.89
2-(2-butoxyethoxy)ethanol	261.2
sec-butyl acetate	135.68
tert-butyl acetate	174.16
decalin	26.49
glycerin	136.78
diglyme	536.96
acrylic acid	174.87
isopropyl myristate	64.43
n-butyric acid	266.66
acetyl acetate	225.1
di(2-ethylhexyl) phthalate	71.08
ethyl propionate	182.9
nitromethane	538.08
1,2-diethoxyethane	360.62
benzonitrile	219.11
trioctyl phosphate	42.75
1-bromopropane	405.73
gamma-valerolactone	464.57
n-decanol	41.53
triethyl phosphate	88.53
4-methyl-2-pentanol	67.47
propionitrile	268.86
vinylene carbonate	235.35
1,1,2-trichlorotrifluoroethane	399.07
DMS	180.56
cumene	66.37
2-octanol	33.66
2-hexanone	197.6
octyl acetate	75.44
limonene	73.89
1,2-dimethoxyethane	458.11
ethyl orthosilicate	83.51
tributyl phosphate	63.79
diacetone alcohol	184.39
N,N-dimethylaniline	150.87
acrylonitrile	322.89
aniline	237.54
1,3-propanediol	192.5
bromobenzene	351.04
dibromomethane	901.68
1,1,2,2-tetrachloroethane	1192.46
2-methyl-cyclohexyl acetate	129.06
tetrabutyl urea	85.25
diisobutyl methanol	53.68
2-phenylethanol	155.84
styrene	169.91
dioctyl adipate	109.61
dimethyl sulfate	201.02
ethyl butyrate	170.45
methyl lactate	114.6
butyl lactate	93.58
diethyl carbonate	137.02
propanediol butyl ether	126.06
triethyl orthoformate	120.31
p-tert-butyltoluene	48.15
methyl 4-tert-butylbenzoate	143.46
morpholine	756.18
tert-butylamine	122.4
n-dodecanol	33.34
dimethoxymethane	359.69
ethylene carbonate	198.76
cyrene	155.95
2-ethoxyethyl acetate	184.93
2-ethylhexyl acetate	142.21
1,2,4-trichlorobenzene	319.74
4-methylpyridine	445.07
dibutyl ether	107.88
2,6-dimethyl-4-heptanol	53.68
DEF	298.68
dimethyl isosorbide	294.49
tetrachloroethylene	619.13
eugenol	151.97
triacetin	185.26
span 80	143.5
1,4-butanediol	87.18
1,1-dichloroethane	656.14
2-methyl-1-pentanol	149.35
methyl formate	149.56
2-methyl-1-butanol	156.27
n-decane	8.41
butyronitrile	228.17
3,7-dimethyl-1-octanol	68.58
1-chlorooctane	46.51
1-chlorotetradecane	21.24
n-nonane	7.51
undecane	6.86
tert-butylcyclohexane	21.52
cyclooctane	10.67
cyclopentanol	139.54
tetrahydropyran	584.02
tert-amyl methyl ether	144.61
2,5,8-trioxanonane	386.34
1-hexene	115.76
2-isopropoxyethanol	188.98
2,2,2-trifluoroethanol	81.7
methyl butyrate	244.4

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