Công thức phân tử
C7H7O4-

SMILES
C=CCOC(=O)/C=C/C(=O)[O-]

Hương thơm
Trái cây	79.76%
Caramel	56.33%
Ngọt	54.28%
Rượu vang	48.36%
Cháy	36.74%
Chua	34.66%
Rượu rum	33.62%
Sắc	33.23%
Dứa	32.77%
Thanh thoát	32.38%

 

Hương vị
Odorless	36.85%
Very mild	29.81%
Nutty	27.12%
Caramellic	25.53%
Fruity	23.86%
Sour	23.52%
Caramel	21.2%
Yeast	20.17%
Cotton candy	20.02%
Acetoin	19.85%

 

Cường độ mùi ước lượng
Thấp

XLogP3-AA
1.2

pKa ước lượng
4.52 (axit yếu)

Khối lượng phân tử
155.13 g/mol

Điểm chớp cháy

• 108.42 ˚C ước lượng

(E)-4-oxo-4-prop-2-enoxybut-2-enoate là một este hữu cơ được dùng chủ yếu làm tiền chất trong tổng hợp hữu cơ, thường đóng vai trò là monomer hoặc tác nhân liên kết chéo trong các hệ polymer và lớp phủ; nó cũng được xem như tiền thân cho các sản phẩm đặc chế trong ngành dược phẩm và hóa chất công nghiệp; trong lĩnh vực coatings/inks và adhesives, nó cung cấp nhóm chức năng liên kết phản ứng để tăng hiệu suất và độ bền của công thức.

gpt-5-nano

Dung môi	Độ tan (g/L)
ethanol	173.44
methanol	293.78
isopropanol	93.95
water	3.0
ethyl acetate	122.93
n-propanol	94.18
acetone	294.87
n-butanol	71.71
acetonitrile	198.97
DMF	558.24
toluene	27.16
isobutanol	57.37
1,4-dioxane	186.59
methyl acetate	257.76
THF	234.83
2-butanone	222.21
n-pentanol	69.68
sec-butanol	100.86
n-hexane	3.11
ethylene glycol	43.03
NMP	453.83
cyclohexane	2.26
DMSO	785.25
n-butyl acetate	76.11
n-octanol	22.23
chloroform	40.38
n-propyl acetate	96.34
acetic acid	135.75
dichloromethane	101.0
cyclohexanone	103.36
propylene glycol	30.02
isopropyl acetate	66.31
DMAc	795.18
2-ethoxyethanol	272.59
isopentanol	72.29
n-heptane	2.16
ethyl formate	101.77
1,2-dichloroethane	97.27
n-hexanol	39.11
2-methoxyethanol	344.27
isobutyl acetate	37.6
tetrachloromethane	5.15
n-pentyl acetate	32.57
transcutol	507.85
n-heptanol	15.67
ethylbenzene	34.9
MIBK	59.64
2-propoxyethanol	123.34
tert-butanol	150.32
MTBE	141.44
2-butoxyethanol	59.05
propionic acid	80.67
o-xylene	32.82
formic acid	141.99
diethyl ether	107.1
m-xylene	21.68
p-xylene	39.24
chlorobenzene	32.34
dimethyl carbonate	78.22
n-octane	1.31
formamide	363.2
cyclopentanone	171.28
2-pentanone	108.87
anisole	145.25
cyclopentyl methyl ether	85.21
gamma-butyrolactone	244.45
1-methoxy-2-propanol	171.83
pyridine	139.77
3-pentanone	88.16
furfural	237.93
n-dodecane	1.62
diethylene glycol	137.6
diisopropyl ether	24.82
tert-amyl alcohol	164.94
acetylacetone	138.04
n-hexadecane	1.8
acetophenone	132.8
methyl propionate	121.69
isopentyl acetate	65.74
trichloroethylene	126.05
n-nonanol	20.6
cyclohexanol	40.4
benzyl alcohol	96.36
2-ethylhexanol	25.63
isooctanol	15.11
dipropyl ether	29.82
1,2-dichlorobenzene	35.86
ethyl lactate	48.75
propylene carbonate	99.98
n-methylformamide	256.9
2-pentanol	51.01
n-pentane	2.84
1-propoxy-2-propanol	70.84
1-methoxy-2-propyl acetate	88.0
2-(2-methoxypropoxy) propanol	121.62
mesitylene	14.42
ε-caprolactone	123.42
p-cymene	17.38
epichlorohydrin	300.06
1,1,1-trichloroethane	40.26
2-aminoethanol	77.11
morpholine-4-carbaldehyde	393.37
sulfolane	290.17
2,2,4-trimethylpentane	3.29
2-methyltetrahydrofuran	197.69
n-hexyl acetate	53.24
isooctane	1.58
2-(2-butoxyethoxy)ethanol	136.36
sec-butyl acetate	60.96
tert-butyl acetate	91.13
decalin	3.95
glycerin	60.13
diglyme	287.99
acrylic acid	79.59
isopropyl myristate	22.39
n-butyric acid	70.1
acetyl acetate	67.94
di(2-ethylhexyl) phthalate	30.22
ethyl propionate	82.08
nitromethane	496.33
1,2-diethoxyethane	118.32
benzonitrile	80.94
trioctyl phosphate	16.66
1-bromopropane	44.72
gamma-valerolactone	249.4
n-decanol	16.58
triethyl phosphate	39.45
4-methyl-2-pentanol	28.44
propionitrile	96.89
vinylene carbonate	86.07
1,1,2-trichlorotrifluoroethane	143.55
DMS	83.5
cumene	24.21
2-octanol	12.89
2-hexanone	96.66
octyl acetate	29.54
limonene	22.5
1,2-dimethoxyethane	374.89
ethyl orthosilicate	33.89
tributyl phosphate	27.89
diacetone alcohol	131.72
N,N-dimethylaniline	107.04
acrylonitrile	145.66
aniline	58.93
1,3-propanediol	107.85
bromobenzene	27.1
dibromomethane	53.22
1,1,2,2-tetrachloroethane	87.08
2-methyl-cyclohexyl acetate	52.17
tetrabutyl urea	45.3
diisobutyl methanol	17.23
2-phenylethanol	62.57
styrene	47.23
dioctyl adipate	44.26
dimethyl sulfate	166.53
ethyl butyrate	57.86
methyl lactate	69.61
butyl lactate	33.25
diethyl carbonate	49.26
propanediol butyl ether	62.79
triethyl orthoformate	40.76
p-tert-butyltoluene	16.12
methyl 4-tert-butylbenzoate	72.55
morpholine	218.28
tert-butylamine	62.09
n-dodecanol	12.89
dimethoxymethane	241.05
ethylene carbonate	61.89
cyrene	116.04
2-ethoxyethyl acetate	79.77
2-ethylhexyl acetate	51.14
1,2,4-trichlorobenzene	55.74
4-methylpyridine	164.44
dibutyl ether	34.39
2,6-dimethyl-4-heptanol	17.23
DEF	197.75
dimethyl isosorbide	182.33
tetrachloroethylene	50.42
eugenol	76.13
triacetin	85.15
span 80	57.88
1,4-butanediol	53.76
1,1-dichloroethane	54.34
2-methyl-1-pentanol	81.68
methyl formate	202.34
2-methyl-1-butanol	77.36
n-decane	2.34
butyronitrile	68.98
3,7-dimethyl-1-octanol	29.69
1-chlorooctane	10.77
1-chlorotetradecane	5.55
n-nonane	2.09
undecane	1.94
tert-butylcyclohexane	3.93
cyclooctane	1.15
cyclopentanol	48.61
tetrahydropyran	95.81
tert-amyl methyl ether	135.34
2,5,8-trioxanonane	213.01
1-hexene	20.06
2-isopropoxyethanol	161.6
2,2,2-trifluoroethanol	61.86
methyl butyrate	113.24

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