Công thức phân tử
C9H16O2

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

Trái cây	97.76%
Dứa	69.22%
Táo	65.86%
Ngọt	50.27%
Rượu vang	43.49%
Chuối	42.56%
Nhiệt đới	41.34%
Béo	40.21%
Thanh thoát	37.47%
Phô mai	34.52%

Scent© AI

XLogP3-AA
2.4

pKa ước lượng
8.244491

Khối lượng phân tử
156.22 g/mol

Áp suất hơi ước lượng

• hPa @ 20°C
• hPa @ 25°C

Tốc độ bay hơi
Nhanh

Nhiệt độ sôi ước lượng
180°C

Nhiệt độ chớp cháy ước lượng
61.5 ˚C

• Allyl 4-methylpentanoate
• SCHEMBL7783972
• Q63408767

Dung môi	Độ tan (g/L)
ethanol	424.69
methanol	459.07
isopropanol	377.1
water	0.5
ethyl acetate	170.77
n-propanol	311.47
acetone	238.18
n-butanol	323.38
acetonitrile	141.18
DMF	393.25
toluene	135.95
isobutanol	251.77
1,4-dioxane	373.11
methyl acetate	178.19
THF	521.09
2-butanone	229.85
n-pentanol	273.01
sec-butanol	324.22
n-hexane	60.54
ethylene glycol	74.1
NMP	258.98
cyclohexane	65.36
DMSO	295.18
n-butyl acetate	294.81
n-octanol	174.01
chloroform	508.29
n-propyl acetate	137.69
acetic acid	245.13
dichloromethane	343.58
cyclohexanone	319.61
propylene glycol	155.35
isopropyl acetate	131.58
DMAc	378.8
2-ethoxyethanol	264.64
isopentanol	313.83
n-heptane	38.2
ethyl formate	140.63
1,2-dichloroethane	227.86
n-hexanol	402.81
2-methoxyethanol	356.06
isobutyl acetate	116.31
tetrachloromethane	69.85
n-pentyl acetate	146.35
transcutol	733.58
n-heptanol	146.91
ethylbenzene	112.42
MIBK	152.97
2-propoxyethanol	421.33
tert-butanol	461.47
MTBE	296.77
2-butoxyethanol	221.05
propionic acid	183.4
o-xylene	106.2
formic acid	69.96
diethyl ether	177.78
m-xylene	116.53
p-xylene	141.31
chlorobenzene	171.86
dimethyl carbonate	50.74
n-octane	19.64
formamide	68.46
cyclopentanone	293.52
2-pentanone	189.65
anisole	186.41
cyclopentyl methyl ether	202.04
gamma-butyrolactone	258.45
1-methoxy-2-propanol	304.7
pyridine	296.14
3-pentanone	121.74
furfural	297.25
n-dodecane	19.14
diethylene glycol	257.84
diisopropyl ether	74.7
tert-amyl alcohol	396.31
acetylacetone	177.36
n-hexadecane	21.21
acetophenone	174.88
methyl propionate	122.98
isopentyl acetate	281.76
trichloroethylene	439.33
n-nonanol	151.11
cyclohexanol	263.43
benzyl alcohol	178.45
2-ethylhexanol	239.64
isooctanol	123.57
dipropyl ether	149.62
1,2-dichlorobenzene	157.87
ethyl lactate	94.89
propylene carbonate	197.79
n-methylformamide	136.1
2-pentanol	233.95
n-pentane	42.99
1-propoxy-2-propanol	326.82
1-methoxy-2-propyl acetate	221.6
2-(2-methoxypropoxy) propanol	258.31
mesitylene	79.26
ε-caprolactone	280.88
p-cymene	88.64
epichlorohydrin	344.15
1,1,1-trichloroethane	239.46
2-aminoethanol	161.32
morpholine-4-carbaldehyde	322.17
sulfolane	293.3
2,2,4-trimethylpentane	33.17
2-methyltetrahydrofuran	360.6
n-hexyl acetate	234.92
isooctane	27.87
2-(2-butoxyethoxy)ethanol	309.4
sec-butyl acetate	122.37
tert-butyl acetate	166.56
decalin	47.29
glycerin	150.08
diglyme	449.97
acrylic acid	140.58
isopropyl myristate	97.89
n-butyric acid	298.41
acetyl acetate	108.02
di(2-ethylhexyl) phthalate	111.92
ethyl propionate	113.57
nitromethane	210.94
1,2-diethoxyethane	246.09
benzonitrile	209.6
trioctyl phosphate	78.05
1-bromopropane	191.76
gamma-valerolactone	375.32
n-decanol	112.72
triethyl phosphate	91.09
4-methyl-2-pentanol	159.27
propionitrile	164.87
vinylene carbonate	182.75
1,1,2-trichlorotrifluoroethane	267.04
DMS	138.0
cumene	87.87
2-octanol	115.43
2-hexanone	190.0
octyl acetate	124.78
limonene	132.02
1,2-dimethoxyethane	394.07
ethyl orthosilicate	92.5
tributyl phosphate	93.66
diacetone alcohol	225.48
N,N-dimethylaniline	148.67
acrylonitrile	176.92
aniline	158.44
1,3-propanediol	234.02
bromobenzene	168.54
dibromomethane	266.58
1,1,2,2-tetrachloroethane	414.78
2-methyl-cyclohexyl acetate	167.32
tetrabutyl urea	124.84
diisobutyl methanol	133.66
2-phenylethanol	225.35
styrene	131.51
dioctyl adipate	143.83
dimethyl sulfate	76.76
ethyl butyrate	168.26
methyl lactate	99.27
butyl lactate	143.42
diethyl carbonate	121.11
propanediol butyl ether	238.67
triethyl orthoformate	128.46
p-tert-butyltoluene	91.67
methyl 4-tert-butylbenzoate	174.17
morpholine	457.1
tert-butylamine	297.26
n-dodecanol	87.59
dimethoxymethane	181.3
ethylene carbonate	150.6
cyrene	171.67
2-ethoxyethyl acetate	184.59
2-ethylhexyl acetate	220.21
1,2,4-trichlorobenzene	189.69
4-methylpyridine	312.07
dibutyl ether	154.44
2,6-dimethyl-4-heptanol	133.66
DEF	209.16
dimethyl isosorbide	312.07
tetrachloroethylene	244.32
eugenol	191.0
triacetin	180.94
span 80	242.72
1,4-butanediol	121.17
1,1-dichloroethane	260.33
2-methyl-1-pentanol	273.44
methyl formate	99.5
2-methyl-1-butanol	271.14
n-decane	29.68
butyronitrile	235.49
3,7-dimethyl-1-octanol	202.41
1-chlorooctane	99.36
1-chlorotetradecane	47.84
n-nonane	28.55
undecane	23.27
tert-butylcyclohexane	50.09
cyclooctane	23.46
cyclopentanol	240.65
tetrahydropyran	363.31
tert-amyl methyl ether	221.18
2,5,8-trioxanonane	344.71
1-hexene	177.93
2-isopropoxyethanol	203.0
2,2,2-trifluoroethanol	58.02
methyl butyrate	170.37

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