Molecular formula
C8H12O2

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

Fragrance
Fruity	90.76%
Green	71.04%
Sweet	64.24%
Herbal	55.96%
Ethereal	47.68%
Apple	47.06%
Pungent	45.95%
Chamomile	43.5%
Rummy	41.58%
Pineapple	39.41%

 

Flavor
Fruity	59.53%
Sweet	48.37%
Spicy	44.34%
Caramel	38.99%
Berry	31.46%
Floral	29.16%
Nutty	29.14%
Woody	29.05%
Tropical	26.88%
Pungent	25.14%

 

Odor impact est.
High

XLogP3-AA
2.0

pKa est.
8.26 (weak base)

Molecular weight
140.18 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Very fast

Boiling point est.
165°C

Flash point

• 54.65 ˚C est.

• DTXSID10864079
• prop-2-en-1-yl 2-methylbut-2-enoate

Prop-2-en-1-yl 2-methylbut-2-enoate is an allyl ester of 2-methylbut-2-enoic acid and is commonly used as a chemical synthesis intermediate and as a fragrance component in perfumery and cosmetics; it may also function as a monomer or precursor for polymers/plastics and coatings/inks, especially UV-curable systems, enabling crosslinking; in the adhesives sector it is used as a reactive monomer for formulation of adhesive systems; and as a building block for the synthesis of specialty chemicals in industrial manufacturing, subject to local regulations.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	771.27
methanol	780.83
isopropanol	715.17
water	1.97
ethyl acetate	781.81
n-propanol	735.36
acetone	775.4
n-butanol	802.98
acetonitrile	1059.22
DMF	710.72
toluene	548.92
isobutanol	680.45
1,4-dioxane	1107.25
methyl acetate	861.44
THF	1086.32
2-butanone	1027.68
n-pentanol	761.24
sec-butanol	1019.38
n-hexane	268.97
ethylene glycol	85.19
NMP	790.02
cyclohexane	346.74
DMSO	514.31
n-butyl acetate	872.0
n-octanol	528.12
chloroform	2650.69
n-propyl acetate	755.39
acetic acid	759.44
dichloromethane	2194.29
cyclohexanone	1140.92
propylene glycol	137.21
isopropyl acetate	435.92
DMAc	849.07
2-ethoxyethanol	646.13
isopentanol	785.09
n-heptane	142.23
ethyl formate	587.78
1,2-dichloroethane	1138.3
n-hexanol	723.2
2-methoxyethanol	625.27
isobutyl acetate	419.74
tetrachloromethane	481.64
n-pentyl acetate	554.6
transcutol	1547.1
n-heptanol	431.43
ethylbenzene	488.91
MIBK	427.28
2-propoxyethanol	656.04
tert-butanol	1101.32
MTBE	1023.92
2-butoxyethanol	486.47
propionic acid	614.04
o-xylene	433.04
formic acid	188.48
diethyl ether	870.08
m-xylene	374.51
p-xylene	686.15
chlorobenzene	811.14
dimethyl carbonate	192.5
n-octane	86.5
formamide	318.46
cyclopentanone	974.99
2-pentanone	707.52
anisole	726.15
cyclopentyl methyl ether	616.34
gamma-butyrolactone	1032.61
1-methoxy-2-propanol	477.19
pyridine	1274.03
3-pentanone	571.6
furfural	1019.04
n-dodecane	71.8
diethylene glycol	317.56
diisopropyl ether	289.18
tert-amyl alcohol	1295.96
acetylacetone	516.7
n-hexadecane	79.93
acetophenone	682.28
methyl propionate	521.31
isopentyl acetate	730.28
trichloroethylene	2378.9
n-nonanol	433.4
cyclohexanol	777.68
benzyl alcohol	567.58
2-ethylhexanol	538.92
isooctanol	368.56
dipropyl ether	448.5
1,2-dichlorobenzene	709.04
ethyl lactate	251.26
propylene carbonate	640.77
n-methylformamide	474.94
2-pentanol	688.42
n-pentane	206.73
1-propoxy-2-propanol	514.16
1-methoxy-2-propyl acetate	431.23
2-(2-methoxypropoxy) propanol	474.83
mesitylene	266.07
ε-caprolactone	984.67
p-cymene	277.84
epichlorohydrin	1234.49
1,1,1-trichloroethane	1436.79
2-aminoethanol	226.27
morpholine-4-carbaldehyde	799.32
sulfolane	875.37
2,2,4-trimethylpentane	140.29
2-methyltetrahydrofuran	1183.99
n-hexyl acetate	806.49
isooctane	96.09
2-(2-butoxyethoxy)ethanol	602.56
sec-butyl acetate	477.23
tert-butyl acetate	480.79
decalin	181.41
glycerin	158.63
diglyme	1025.28
acrylic acid	515.93
isopropyl myristate	287.86
n-butyric acid	825.06
acetyl acetate	438.8
di(2-ethylhexyl) phthalate	245.13
ethyl propionate	553.56
nitromethane	1152.18
1,2-diethoxyethane	739.71
benzonitrile	894.1
trioctyl phosphate	183.57
1-bromopropane	966.39
gamma-valerolactone	1041.25
n-decanol	306.16
triethyl phosphate	254.01
4-methyl-2-pentanol	380.81
propionitrile	883.04
vinylene carbonate	663.67
1,1,2-trichlorotrifluoroethane	709.49
DMS	423.78
cumene	350.9
2-octanol	400.8
2-hexanone	781.19
octyl acetate	364.94
limonene	374.74
1,2-dimethoxyethane	1124.49
ethyl orthosilicate	256.29
tributyl phosphate	232.11
diacetone alcohol	469.92
N,N-dimethylaniline	493.77
acrylonitrile	916.5
aniline	542.91
1,3-propanediol	390.83
bromobenzene	889.54
dibromomethane	1644.85
1,1,2,2-tetrachloroethane	1697.06
2-methyl-cyclohexyl acetate	457.7
tetrabutyl urea	282.49
diisobutyl methanol	278.82
2-phenylethanol	543.31
styrene	611.92
dioctyl adipate	362.93
dimethyl sulfate	255.2
ethyl butyrate	596.19
methyl lactate	187.96
butyl lactate	337.95
diethyl carbonate	443.27
propanediol butyl ether	424.76
triethyl orthoformate	361.98
p-tert-butyltoluene	253.55
methyl 4-tert-butylbenzoate	454.05
morpholine	1171.87
tert-butylamine	853.26
n-dodecanol	231.5
dimethoxymethane	436.31
ethylene carbonate	511.52
cyrene	386.57
2-ethoxyethyl acetate	541.9
2-ethylhexyl acetate	588.82
1,2,4-trichlorobenzene	766.9
4-methylpyridine	1232.23
dibutyl ether	579.92
2,6-dimethyl-4-heptanol	278.82
DEF	750.59
dimethyl isosorbide	644.45
tetrachloroethylene	1135.39
eugenol	460.49
triacetin	493.9
span 80	411.4
1,4-butanediol	225.5
1,1-dichloroethane	1465.58
2-methyl-1-pentanol	840.85
methyl formate	368.84
2-methyl-1-butanol	835.37
n-decane	120.37
butyronitrile	1021.21
3,7-dimethyl-1-octanol	468.94
1-chlorooctane	385.8
1-chlorotetradecane	154.65
n-nonane	122.19
undecane	88.72
tert-butylcyclohexane	175.04
cyclooctane	107.61
cyclopentanol	677.05
tetrahydropyran	1253.29
tert-amyl methyl ether	784.85
2,5,8-trioxanonane	697.3
1-hexene	709.23
2-isopropoxyethanol	506.43
2,2,2-trifluoroethanol	221.73
methyl butyrate	806.51

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