Công thức phân tử
C11H20O

SMILES
CCCC=CC(=O)CCC(C)C

Hương thơm
Trái cây	76.56%
Thảo mộc	68.91%
Đất	37.89%
Cay	36.14%
Keton	35.51%
Nấm	33.71%
Dầu	33.47%
Tươi mát	32.34%
Ngọt	31.73%
Kim loại	31.56%

 

Hương vị
Herbal	52.16%
Fruity	51.6%
Green	34.99%
Spicy	34.49%
Mushroom	25.6%
Oily	25.1%
Fatty	24.33%
Floral	23.59%
Sweet	21.93%
Fresh	20.69%

 

Cường độ mùi ước lượng
Mạnh

XLogP3-AA
3.4

pKa ước lượng
8.62 (kiềm yếu)

Khối lượng phân tử
168.28 g/mol

Áp suất hơi ước lượng

• hPa @ 20°C
• hPa @ 25°C

Tốc độ bay hơi
Trung bình

Điểm sôi ước lượng
220°C

Điểm chớp cháy

• 83.83 ˚C ước lượng

Dung môi	Độ tan (g/L)
ethanol	1432.35
methanol	985.91
isopropanol	1444.13
water	0.2
ethyl acetate	973.39
n-propanol	1127.09
acetone	1349.07
n-butanol	1236.89
acetonitrile	709.84
DMF	1328.01
toluene	506.68
isobutanol	990.54
1,4-dioxane	1400.82
methyl acetate	775.88
THF	2048.11
2-butanone	1078.02
n-pentanol	854.43
sec-butanol	1172.81
n-hexane	578.51
ethylene glycol	157.02
NMP	830.43
cyclohexane	548.92
DMSO	917.68
n-butyl acetate	1414.4
n-octanol	506.69
chloroform	2366.23
n-propyl acetate	651.32
acetic acid	684.5
dichloromethane	1642.9
cyclohexanone	1527.47
propylene glycol	386.82
isopropyl acetate	716.54
DMAc	875.91
2-ethoxyethanol	623.85
isopentanol	1158.43
n-heptane	293.64
ethyl formate	503.44
1,2-dichloroethane	1168.24
n-hexanol	1506.86
2-methoxyethanol	1018.99
isobutyl acetate	488.72
tetrachloromethane	392.82
n-pentyl acetate	550.51
transcutol	2322.71
n-heptanol	487.72
ethylbenzene	363.87
MIBK	659.02
2-propoxyethanol	1343.19
tert-butanol	1739.25
MTBE	1444.48
2-butoxyethanol	650.59
propionic acid	627.46
o-xylene	339.85
formic acid	121.51
diethyl ether	1160.37
m-xylene	414.27
p-xylene	451.92
chlorobenzene	684.14
dimethyl carbonate	184.63
n-octane	101.5
formamide	159.12
cyclopentanone	1322.34
2-pentanone	1019.82
anisole	561.77
cyclopentyl methyl ether	998.65
gamma-butyrolactone	1068.73
1-methoxy-2-propanol	1031.18
pyridine	1099.12
3-pentanone	603.06
furfural	944.16
n-dodecane	67.73
diethylene glycol	651.78
diisopropyl ether	418.5
tert-amyl alcohol	1316.66
acetylacetone	860.07
n-hexadecane	77.12
acetophenone	489.39
methyl propionate	568.55
isopentyl acetate	1222.96
trichloroethylene	2063.64
n-nonanol	429.25
cyclohexanol	1093.76
benzyl alcohol	476.7
2-ethylhexanol	882.2
isooctanol	417.22
dipropyl ether	896.18
1,2-dichlorobenzene	590.28
ethyl lactate	275.65
propylene carbonate	746.53
n-methylformamide	420.05
2-pentanol	997.92
n-pentane	347.22
1-propoxy-2-propanol	1197.3
1-methoxy-2-propyl acetate	911.14
2-(2-methoxypropoxy) propanol	642.28
mesitylene	294.4
ε-caprolactone	1097.04
p-cymene	288.19
epichlorohydrin	1369.33
1,1,1-trichloroethane	1310.58
2-aminoethanol	422.5
morpholine-4-carbaldehyde	945.51
sulfolane	1105.73
2,2,4-trimethylpentane	140.24
2-methyltetrahydrofuran	1588.81
n-hexyl acetate	826.52
isooctane	139.02
2-(2-butoxyethoxy)ethanol	833.21
sec-butyl acetate	515.48
tert-butyl acetate	758.44
decalin	219.78
glycerin	364.58
diglyme	1330.66
acrylic acid	430.55
isopropyl myristate	340.21
n-butyric acid	1297.63
acetyl acetate	489.42
di(2-ethylhexyl) phthalate	290.04
ethyl propionate	505.64
nitromethane	727.13
1,2-diethoxyethane	990.75
benzonitrile	696.49
trioctyl phosphate	218.29
1-bromopropane	1082.76
gamma-valerolactone	1452.98
n-decanol	313.09
triethyl phosphate	260.14
4-methyl-2-pentanol	596.87
propionitrile	747.91
vinylene carbonate	593.76
1,1,2-trichlorotrifluoroethane	879.14
DMS	443.5
cumene	280.85
2-octanol	369.68
2-hexanone	837.99
octyl acetate	390.98
limonene	490.33
1,2-dimethoxyethane	1217.59
ethyl orthosilicate	271.79
tributyl phosphate	269.93
diacetone alcohol	782.56
N,N-dimethylaniline	414.29
acrylonitrile	701.32
aniline	567.96
1,3-propanediol	666.72
bromobenzene	742.03
dibromomethane	1334.5
1,1,2,2-tetrachloroethane	1902.02
2-methyl-cyclohexyl acetate	545.6
tetrabutyl urea	335.6
diisobutyl methanol	462.04
2-phenylethanol	667.86
styrene	457.51
dioctyl adipate	430.07
dimethyl sulfate	256.24
ethyl butyrate	720.46
methyl lactate	312.47
butyl lactate	457.38
diethyl carbonate	421.9
propanediol butyl ether	652.35
triethyl orthoformate	459.17
p-tert-butyltoluene	296.6
methyl 4-tert-butylbenzoate	473.39
morpholine	1781.54
tert-butylamine	1187.26
n-dodecanol	242.51
dimethoxymethane	652.79
ethylene carbonate	548.9
cyrene	397.31
2-ethoxyethyl acetate	612.56
2-ethylhexyl acetate	917.26
1,2,4-trichlorobenzene	667.83
4-methylpyridine	1206.09
dibutyl ether	699.31
2,6-dimethyl-4-heptanol	462.04
DEF	860.17
dimethyl isosorbide	845.92
tetrachloroethylene	1089.91
eugenol	489.32
triacetin	572.26
span 80	662.0
1,4-butanediol	279.05
1,1-dichloroethane	1491.47
2-methyl-1-pentanol	784.19
methyl formate	288.13
2-methyl-1-butanol	948.48
n-decane	117.42
butyronitrile	1082.83
3,7-dimethyl-1-octanol	581.03
1-chlorooctane	363.31
1-chlorotetradecane	152.83
n-nonane	128.89
undecane	85.12
tert-butylcyclohexane	219.05
cyclooctane	170.19
cyclopentanol	935.14
tetrahydropyran	1901.22
tert-amyl methyl ether	861.2
2,5,8-trioxanonane	853.49
1-hexene	1151.09
2-isopropoxyethanol	569.54
2,2,2-trifluoroethanol	159.36
methyl butyrate	730.53

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