Công thức phân tử
C12H18O3

SMILES
CC(OC)OC(C)OCC1=CC=CC=C1

Xanh	88.75%
Trái cây	78.45%
Ngọt	75.02%
Hạnh nhân	56.55%
Đắng	46.55%
Đất	40.04%
Tươi mát	36.21%
Lá cây	34.32%
Rau củ	33.56%
Hoa	32.86%

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XLogP3-AA
2.3

pKa ước lượng
7.06 (trung tính)

Khối lượng phân tử
210.27 g/mol

Áp suất hơi ước lượng

• hPa @ 20°C
• hPa @ 25°C

Tốc độ bay hơi
Chậm

Nhiệt độ sôi ước lượng
250°C

Nhiệt độ chớp cháy ước lượng
100.46 ˚C

• SCHEMBL4236137

Dung môi	Độ tan (g/L)
ethanol	722.78
methanol	669.22
isopropanol	579.73
water	3.6
ethyl acetate	682.83
n-propanol	553.63
acetone	454.8
n-butanol	509.3
acetonitrile	602.45
DMF	386.8
toluene	282.45
isobutanol	413.44
1,4-dioxane	1344.88
methyl acetate	527.86
THF	825.74
2-butanone	432.13
n-pentanol	391.99
sec-butanol	548.04
n-hexane	113.9
ethylene glycol	177.36
NMP	301.96
cyclohexane	215.88
DMSO	780.66
n-butyl acetate	279.13
n-octanol	137.29
chloroform	2763.43
n-propyl acetate	309.33
acetic acid	733.09
dichloromethane	2460.12
cyclohexanone	543.29
propylene glycol	254.21
isopropyl acetate	307.29
DMAc	612.63
2-ethoxyethanol	629.9
isopentanol	373.32
n-heptane	60.19
ethyl formate	286.1
1,2-dichloroethane	1167.79
n-hexanol	309.12
2-methoxyethanol	719.54
isobutyl acetate	199.7
tetrachloromethane	347.3
n-pentyl acetate	161.91
transcutol	1070.53
n-heptanol	116.21
ethylbenzene	162.71
MIBK	193.59
2-propoxyethanol	460.14
tert-butanol	733.03
MTBE	550.75
2-butoxyethanol	215.67
propionic acid	437.62
o-xylene	184.81
formic acid	237.87
diethyl ether	747.77
m-xylene	168.47
p-xylene	214.2
chlorobenzene	370.63
dimethyl carbonate	166.96
n-octane	24.59
formamide	275.15
cyclopentanone	412.49
2-pentanone	319.3
anisole	320.69
cyclopentyl methyl ether	422.36
gamma-butyrolactone	517.3
1-methoxy-2-propanol	495.67
pyridine	663.93
3-pentanone	314.07
furfural	480.2
n-dodecane	21.6
diethylene glycol	360.42
diisopropyl ether	157.62
tert-amyl alcohol	555.34
acetylacetone	379.44
n-hexadecane	24.18
acetophenone	262.59
methyl propionate	386.88
isopentyl acetate	244.31
trichloroethylene	1724.52
n-nonanol	126.23
cyclohexanol	493.25
benzyl alcohol	262.33
2-ethylhexanol	176.05
isooctanol	96.64
dipropyl ether	257.91
1,2-dichlorobenzene	365.46
ethyl lactate	171.43
propylene carbonate	331.52
n-methylformamide	224.64
2-pentanol	344.61
n-pentane	87.96
1-propoxy-2-propanol	301.39
1-methoxy-2-propyl acetate	261.89
2-(2-methoxypropoxy) propanol	249.6
mesitylene	112.98
ε-caprolactone	502.36
p-cymene	90.55
epichlorohydrin	826.29
1,1,1-trichloroethane	992.3
2-aminoethanol	338.7
morpholine-4-carbaldehyde	494.16
sulfolane	554.61
2,2,4-trimethylpentane	49.24
2-methyltetrahydrofuran	674.14
n-hexyl acetate	234.29
isooctane	27.66
2-(2-butoxyethoxy)ethanol	325.29
sec-butyl acetate	220.21
tert-butyl acetate	292.0
decalin	76.94
glycerin	303.7
diglyme	603.78
acrylic acid	345.21
isopropyl myristate	105.72
n-butyric acid	531.19
acetyl acetate	437.54
di(2-ethylhexyl) phthalate	103.7
ethyl propionate	289.27
nitromethane	705.56
1,2-diethoxyethane	420.73
benzonitrile	277.81
trioctyl phosphate	69.71
1-bromopropane	699.41
gamma-valerolactone	539.68
n-decanol	95.0
triethyl phosphate	148.14
4-methyl-2-pentanol	155.32
propionitrile	420.35
vinylene carbonate	346.32
1,1,2-trichlorotrifluoroethane	643.27
DMS	214.73
cumene	110.99
2-octanol	84.82
2-hexanone	262.24
octyl acetate	128.49
limonene	136.05
1,2-dimethoxyethane	824.02
ethyl orthosilicate	145.59
tributyl phosphate	100.17
diacetone alcohol	271.57
N,N-dimethylaniline	213.6
acrylonitrile	408.92
aniline	341.1
1,3-propanediol	432.72
bromobenzene	438.51
dibromomethane	1583.86
1,1,2,2-tetrachloroethane	1672.4
2-methyl-cyclohexyl acetate	195.43
tetrabutyl urea	116.84
diisobutyl methanol	102.38
2-phenylethanol	199.8
styrene	208.43
dioctyl adipate	162.96
dimethyl sulfate	256.07
ethyl butyrate	244.09
methyl lactate	187.27
butyl lactate	135.62
diethyl carbonate	199.36
propanediol butyl ether	201.63
triethyl orthoformate	189.16
p-tert-butyltoluene	89.06
methyl 4-tert-butylbenzoate	205.26
morpholine	1243.82
tert-butylamine	477.84
n-dodecanol	76.79
dimethoxymethane	407.56
ethylene carbonate	318.89
cyrene	233.54
2-ethoxyethyl acetate	234.07
2-ethylhexyl acetate	202.58
1,2,4-trichlorobenzene	423.37
4-methylpyridine	515.98
dibutyl ether	205.52
2,6-dimethyl-4-heptanol	102.38
DEF	394.71
dimethyl isosorbide	339.63
tetrachloroethylene	1016.84
eugenol	198.01
triacetin	272.4
span 80	206.92
1,4-butanediol	222.74
1,1-dichloroethane	1148.04
2-methyl-1-pentanol	300.6
methyl formate	183.08
2-methyl-1-butanol	378.78
n-decane	35.5
butyronitrile	416.14
3,7-dimethyl-1-octanol	139.7
1-chlorooctane	117.84
1-chlorotetradecane	53.68
n-nonane	35.53
undecane	26.22
tert-butylcyclohexane	64.69
cyclooctane	57.8
cyclopentanol	365.87
tetrahydropyran	1082.86
tert-amyl methyl ether	399.29
2,5,8-trioxanonane	442.34
1-hexene	279.71
2-isopropoxyethanol	396.3
2,2,2-trifluoroethanol	268.93
methyl butyrate	358.77

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