Molecular formula
C17H24O3

SMILES
CCOC(=O)C1C(O1)C2=C(C=C(C=C2)C(C)C)C(C)C

Fragrance
Fruity	65.9%
Herbal	48.1%
Floral	36.37%
Green	34.24%
Woody	33.98%
Fresh	31.1%
Spicy	29.55%
Balsamic	27.1%
Mint	26.12%
Sweet	25.82%

 

Flavor
Bitter	56.41%
Herbal	26.45%
Cedarleaf	20.91%
Green pepper	20.12%
Bland	19.85%
Parsley	19.82%
Carrot	19.66%
Heather	19.61%
Lovage	19.6%
Broom	19.47%

 

Odor impact est.
Medium

XLogP3-AA
4.0

pKa est.
6.27 (neutral)

Molecular weight
276.4 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Ultra slow

Boiling point est.
337°C

Flash point

• 133.25 ˚C est.

ethyl 3-[2,4-di(propan-2-yl)phenyl]oxirane-2-carboxylate is a compound containing an epoxide and an ester that is used as a reactive intermediate in organic synthesis. It is considered as a building block for pharmaceutical and agrochemical research, enabling epoxide opening and subsequent functionalization to furnish complex molecules. In coatings, adhesives and composite materials, it can function as a reactive diluent or monomer in epoxy resin systems, contributing to crosslinking and performance tuning. It is also used as a specialized precursor in polymer chemistry and as a research chemical in method development and process-scale studies, with compliance to local regulations and formulation constraints.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	223.81
methanol	137.39
isopropanol	155.52
water	0.04
ethyl acetate	596.4
n-propanol	228.84
acetone	575.79
n-butanol	202.76
acetonitrile	318.51
DMF	603.6
toluene	370.46
isobutanol	170.47
1,4-dioxane	579.37
methyl acetate	536.9
THF	859.39
2-butanone	652.43
n-pentanol	162.83
sec-butanol	198.06
n-hexane	17.73
ethylene glycol	26.37
NMP	591.09
cyclohexane	40.56
DMSO	304.32
n-butyl acetate	337.77
n-octanol	45.33
chloroform	1450.19
n-propyl acetate	335.52
acetic acid	195.5
dichloromethane	1646.06
cyclohexanone	730.47
propylene glycol	50.22
isopropyl acetate	352.45
DMAc	601.01
2-ethoxyethanol	298.98
isopentanol	187.08
n-heptane	7.59
ethyl formate	216.55
1,2-dichloroethane	1081.24
n-hexanol	143.29
2-methoxyethanol	348.41
isobutyl acetate	214.43
tetrachloromethane	141.29
n-pentyl acetate	207.55
transcutol	570.34
n-heptanol	63.93
ethylbenzene	160.76
MIBK	262.6
2-propoxyethanol	303.64
tert-butanol	176.33
MTBE	344.7
2-butoxyethanol	173.64
propionic acid	198.4
o-xylene	181.2
formic acid	45.2
diethyl ether	479.29
m-xylene	190.25
p-xylene	206.58
chlorobenzene	486.39
dimethyl carbonate	189.39
n-octane	4.28
formamide	111.04
cyclopentanone	846.62
2-pentanone	523.0
anisole	312.15
cyclopentyl methyl ether	468.01
gamma-butyrolactone	754.85
1-methoxy-2-propanol	272.08
pyridine	786.01
3-pentanone	471.76
furfural	539.82
n-dodecane	3.26
diethylene glycol	181.38
diisopropyl ether	116.88
tert-amyl alcohol	195.87
acetylacetone	514.74
n-hexadecane	4.03
acetophenone	323.43
methyl propionate	493.79
isopentyl acetate	291.82
trichloroethylene	1739.97
n-nonanol	47.55
cyclohexanol	222.96
benzyl alcohol	249.74
2-ethylhexanol	95.17
isooctanol	60.68
dipropyl ether	111.93
1,2-dichlorobenzene	399.5
ethyl lactate	120.2
propylene carbonate	377.08
n-methylformamide	229.02
2-pentanol	157.17
n-pentane	16.68
1-propoxy-2-propanol	188.28
1-methoxy-2-propyl acetate	320.43
2-(2-methoxypropoxy) propanol	150.37
mesitylene	94.75
ε-caprolactone	592.29
p-cymene	68.88
epichlorohydrin	1199.03
1,1,1-trichloroethane	724.96
2-aminoethanol	75.86
morpholine-4-carbaldehyde	545.52
sulfolane	603.48
2,2,4-trimethylpentane	16.3
2-methyltetrahydrofuran	695.36
n-hexyl acetate	209.16
isooctane	10.06
2-(2-butoxyethoxy)ethanol	191.99
sec-butyl acetate	254.84
tert-butyl acetate	302.31
decalin	26.55
glycerin	63.5
diglyme	416.89
acrylic acid	160.7
isopropyl myristate	66.6
n-butyric acid	286.85
acetyl acetate	305.58
di(2-ethylhexyl) phthalate	77.44
ethyl propionate	294.21
nitromethane	427.67
1,2-diethoxyethane	279.84
benzonitrile	297.67
trioctyl phosphate	45.03
1-bromopropane	511.86
gamma-valerolactone	836.34
n-decanol	33.41
triethyl phosphate	102.01
4-methyl-2-pentanol	91.82
propionitrile	299.87
vinylene carbonate	332.98
1,1,2-trichlorotrifluoroethane	514.73
DMS	260.3
cumene	92.44
2-octanol	46.9
2-hexanone	311.95
octyl acetate	87.25
limonene	95.4
1,2-dimethoxyethane	465.39
ethyl orthosilicate	95.69
tributyl phosphate	59.79
diacetone alcohol	263.02
N,N-dimethylaniline	169.73
acrylonitrile	344.03
aniline	333.34
1,3-propanediol	131.49
bromobenzene	567.44
dibromomethane	1016.08
1,1,2,2-tetrachloroethane	1211.26
2-methyl-cyclohexyl acetate	181.57
tetrabutyl urea	77.7
diisobutyl methanol	54.65
2-phenylethanol	221.88
styrene	218.53
dioctyl adipate	108.66
dimethyl sulfate	245.23
ethyl butyrate	198.95
methyl lactate	136.47
butyl lactate	123.13
diethyl carbonate	146.56
propanediol butyl ether	111.49
triethyl orthoformate	135.15
p-tert-butyltoluene	60.88
methyl 4-tert-butylbenzoate	167.25
morpholine	731.02
tert-butylamine	109.56
n-dodecanol	24.38
dimethoxymethane	455.76
ethylene carbonate	295.87
cyrene	195.42
2-ethoxyethyl acetate	338.83
2-ethylhexyl acetate	244.66
1,2,4-trichlorobenzene	490.14
4-methylpyridine	699.9
dibutyl ether	83.68
2,6-dimethyl-4-heptanol	54.65
DEF	492.43
dimethyl isosorbide	283.73
tetrachloroethylene	689.14
eugenol	154.89
triacetin	197.2
span 80	110.58
1,4-butanediol	71.54
1,1-dichloroethane	881.49
2-methyl-1-pentanol	171.72
methyl formate	184.05
2-methyl-1-butanol	197.76
n-decane	5.75
butyronitrile	274.07
3,7-dimethyl-1-octanol	62.21
1-chlorooctane	47.41
1-chlorotetradecane	17.04
n-nonane	4.96
undecane	4.13
tert-butylcyclohexane	20.87
cyclooctane	11.26
cyclopentanol	217.89
tetrahydropyran	648.78
tert-amyl methyl ether	264.87
2,5,8-trioxanonane	240.85
1-hexene	105.94
2-isopropoxyethanol	242.86
2,2,2-trifluoroethanol	86.0
methyl butyrate	358.85

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