SMILES
CCC(=O)CCC(C)(C)c1cccc(C)c1

Chỉ số lưu (RI)

• DB5: 1630.0

Hoa	78.22%
Gỗ	61.74%
Khô	38.96%
Xanh	35.3%
Phấn	34.99%
Rễ diên vĩ	34.66%
Hoa ly	34.5%
Trái cây	34.46%
Hoa hồng	33.29%
Ngọt	32.84%

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pKa ước lượng
8.65 (kiềm yếu)

Áp suất hơi ước lượng

• hPa @ 20°C
• hPa @ 25°C

Tốc độ bay hơi
Cực chậm

Nhiệt độ sôi ước lượng
289°C

Nhiệt độ chớp cháy ước lượng
123.28 ˚C

Dung môi	Độ tan (g/L)
ethanol	963.59
methanol	667.98
isopropanol	969.3
water	0.53
ethyl acetate	1649.54
n-propanol	866.63
acetone	1400.96
n-butanol	791.08
acetonitrile	956.74
DMF	1456.83
toluene	661.67
isobutanol	629.89
1,4-dioxane	2110.4
methyl acetate	1451.66
THF	1826.02
2-butanone	1534.91
n-pentanol	549.05
sec-butanol	721.81
n-hexane	128.47
ethylene glycol	107.85
NMP	609.68
cyclohexane	143.85
DMSO	611.15
n-butyl acetate	1147.18
n-octanol	358.99
chloroform	2494.04
n-propyl acetate	826.38
acetic acid	363.13
dichloromethane	2108.25
cyclohexanone	1444.37
propylene glycol	255.41
isopropyl acetate	948.86
DMAc	1275.83
2-ethoxyethanol	718.8
isopentanol	664.61
n-heptane	79.48
ethyl formate	712.24
1,2-dichloroethane	1320.91
n-hexanol	861.15
2-methoxyethanol	1007.96
isobutyl acetate	646.22
tetrachloromethane	317.72
n-pentyl acetate	502.84
transcutol	2007.29
n-heptanol	342.61
ethylbenzene	497.68
MIBK	654.69
2-propoxyethanol	1166.53
tert-butanol	1085.27
MTBE	1285.25
2-butoxyethanol	556.86
propionic acid	495.05
o-xylene	426.42
formic acid	84.14
diethyl ether	1267.1
m-xylene	461.53
p-xylene	602.57
chlorobenzene	763.21
dimethyl carbonate	366.27
n-octane	48.36
formamide	181.36
cyclopentanone	1360.47
2-pentanone	1084.1
anisole	911.41
cyclopentyl methyl ether	782.61
gamma-butyrolactone	1184.15
1-methoxy-2-propanol	908.55
pyridine	1196.38
3-pentanone	911.52
furfural	1019.87
n-dodecane	39.41
diethylene glycol	556.94
diisopropyl ether	347.02
tert-amyl alcohol	744.07
acetylacetone	1072.39
n-hexadecane	46.11
acetophenone	688.9
methyl propionate	956.34
isopentyl acetate	1015.46
trichloroethylene	2253.0
n-nonanol	314.87
cyclohexanol	567.71
benzyl alcohol	537.82
2-ethylhexanol	492.25
isooctanol	286.73
dipropyl ether	629.03
1,2-dichlorobenzene	664.85
ethyl lactate	298.22
propylene carbonate	758.73
n-methylformamide	505.78
2-pentanol	552.26
n-pentane	72.27
1-propoxy-2-propanol	864.46
1-methoxy-2-propyl acetate	912.67
2-(2-methoxypropoxy) propanol	499.02
mesitylene	277.52
ε-caprolactone	1106.76
p-cymene	243.26
epichlorohydrin	1601.9
1,1,1-trichloroethane	1364.48
2-aminoethanol	296.63
morpholine-4-carbaldehyde	1162.36
sulfolane	828.52
2,2,4-trimethylpentane	53.04
2-methyltetrahydrofuran	1260.25
n-hexyl acetate	771.72
isooctane	48.05
2-(2-butoxyethoxy)ethanol	705.32
sec-butyl acetate	644.11
tert-butyl acetate	859.06
decalin	108.21
glycerin	244.7
diglyme	1271.71
acrylic acid	329.55
isopropyl myristate	311.04
n-butyric acid	825.85
acetyl acetate	737.52
di(2-ethylhexyl) phthalate	233.72
ethyl propionate	720.6
nitromethane	802.19
1,2-diethoxyethane	1083.65
benzonitrile	684.99
trioctyl phosphate	170.0
1-bromopropane	920.59
gamma-valerolactone	1620.74
n-decanol	242.58
triethyl phosphate	250.77
4-methyl-2-pentanol	340.33
propionitrile	950.3
vinylene carbonate	748.68
1,1,2-trichlorotrifluoroethane	722.15
DMS	618.39
cumene	321.58
2-octanol	250.5
2-hexanone	837.86
octyl acetate	383.65
limonene	325.88
1,2-dimethoxyethane	1432.96
ethyl orthosilicate	247.76
tributyl phosphate	233.06
diacetone alcohol	703.39
N,N-dimethylaniline	528.77
acrylonitrile	887.93
aniline	608.21
1,3-propanediol	469.34
bromobenzene	852.96
dibromomethane	1370.02
1,1,2,2-tetrachloroethane	1784.83
2-methyl-cyclohexyl acetate	493.51
tetrabutyl urea	273.32
diisobutyl methanol	246.72
2-phenylethanol	623.62
styrene	609.03
dioctyl adipate	382.4
dimethyl sulfate	405.58
ethyl butyrate	748.53
methyl lactate	342.37
butyl lactate	364.2
diethyl carbonate	453.17
propanediol butyl ether	461.49
triethyl orthoformate	415.53
p-tert-butyltoluene	240.3
methyl 4-tert-butylbenzoate	483.6
morpholine	1921.82
tert-butylamine	653.9
n-dodecanol	190.45
dimethoxymethane	938.69
ethylene carbonate	678.3
cyrene	392.84
2-ethoxyethyl acetate	733.28
2-ethylhexyl acetate	721.83
1,2,4-trichlorobenzene	720.6
4-methylpyridine	1359.87
dibutyl ether	572.59
2,6-dimethyl-4-heptanol	246.72
DEF	1023.98
dimethyl isosorbide	748.59
tetrachloroethylene	1001.14
eugenol	451.09
triacetin	612.06
span 80	430.27
1,4-butanediol	225.25
1,1-dichloroethane	1583.23
2-methyl-1-pentanol	491.32
methyl formate	423.55
2-methyl-1-butanol	567.72
n-decane	71.08
butyronitrile	989.94
3,7-dimethyl-1-octanol	359.71
1-chlorooctane	296.03
1-chlorotetradecane	116.07
n-nonane	68.99
undecane	50.96
tert-butylcyclohexane	109.59
cyclooctane	50.95
cyclopentanol	489.09
tetrahydropyran	1718.14
tert-amyl methyl ether	725.86
2,5,8-trioxanonane	788.34
1-hexene	565.56
2-isopropoxyethanol	607.98
2,2,2-trifluoroethanol	141.48
methyl butyrate	927.57

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