Molecular formula
C11H12O3

SMILES
CC1C(O1)(C2=CC=CC=C2)C(=O)OC

Fragrance
Fruity	93.95%
Sweet	62.05%
Berry	60.35%
Caramellic	42.86%
Strawberry	42.48%
Honey	30.7%
Tropical	30.0%
Grape	29.99%
Buttery	27.5%
Floral	26.58%

 

Flavor
Bitter	67.08%
Fruity	58.21%
Floral	33.15%
Sweet	32.99%
Grape	27.25%
Wine	21.85%
Musty	21.24%
Orange blossom	20.72%
Orange flower	20.63%
Strawberry	20.51%

 

Odor impact est.
Medium

XLogP3-AA
1.7

pKa est.
5.92 (weak acid)

Molecular weight
192.21 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Slow

Boiling point est.
252°C

Flash point

• 114.93 ˚C est.

Methyl 3-methyl-2-phenyloxirane-2-carboxylate is commonly used as an organic-synthesis intermediate, enabling epoxide opening and subsequent functionalization to access chiral building blocks for medicinal and agrochemical chemistry. As a glycidyl ester, it serves as a versatile precursor for constructing more complex molecules, including beta-hydroxy esters and related derivatives. In polymer and coatings applications, it can function as a reactive glycidyl monomer or crosslinking precursor for epoxy resin formulations. It is also used as a research and development precursor to access α-aryl glycidic esters and related intermediates, with specific use depending on synthetic routes and regulatory constraints.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	303.18
methanol	436.29
isopropanol	211.73
water	4.09
ethyl acetate	280.37
n-propanol	230.32
acetone	478.8
n-butanol	185.57
acetonitrile	418.57
DMF	580.59
toluene	142.68
isobutanol	161.93
1,4-dioxane	532.57
methyl acetate	354.65
THF	496.8
2-butanone	344.25
n-pentanol	154.62
sec-butanol	175.9
n-hexane	8.98
ethylene glycol	197.74
NMP	319.59
cyclohexane	24.39
DMSO	412.04
n-butyl acetate	143.73
n-octanol	87.8
chloroform	1006.45
n-propyl acetate	185.25
acetic acid	351.31
dichloromethane	1060.99
cyclohexanone	403.85
propylene glycol	122.4
isopropyl acetate	158.95
DMAc	333.97
2-ethoxyethanol	346.94
isopentanol	150.59
n-heptane	10.21
ethyl formate	288.27
1,2-dichloroethane	613.17
n-hexanol	131.09
2-methoxyethanol	564.6
isobutyl acetate	112.78
tetrachloromethane	124.07
n-pentyl acetate	122.74
transcutol	316.76
n-heptanol	84.15
ethylbenzene	89.37
MIBK	155.09
2-propoxyethanol	256.29
tert-butanol	216.51
MTBE	159.16
2-butoxyethanol	175.48
propionic acid	231.03
o-xylene	90.43
formic acid	228.56
diethyl ether	189.88
m-xylene	98.76
p-xylene	111.4
chlorobenzene	265.88
dimethyl carbonate	189.25
n-octane	8.67
formamide	476.01
cyclopentanone	466.9
2-pentanone	236.56
anisole	204.59
cyclopentyl methyl ether	177.49
gamma-butyrolactone	582.11
1-methoxy-2-propanol	304.55
pyridine	482.43
3-pentanone	192.31
furfural	504.96
n-dodecane	10.45
diethylene glycol	290.95
diisopropyl ether	57.05
tert-amyl alcohol	171.06
acetylacetone	312.18
n-hexadecane	12.01
acetophenone	197.61
methyl propionate	256.5
isopentyl acetate	126.36
trichloroethylene	1075.3
n-nonanol	79.61
cyclohexanol	159.97
benzyl alcohol	202.99
2-ethylhexanol	76.04
isooctanol	72.76
dipropyl ether	67.84
1,2-dichlorobenzene	236.26
ethyl lactate	111.2
propylene carbonate	289.87
n-methylformamide	440.03
2-pentanol	114.86
n-pentane	11.51
1-propoxy-2-propanol	137.77
1-methoxy-2-propyl acetate	147.27
2-(2-methoxypropoxy) propanol	117.7
mesitylene	62.71
ε-caprolactone	309.25
p-cymene	52.12
epichlorohydrin	734.93
1,1,1-trichloroethane	409.95
2-aminoethanol	236.3
morpholine-4-carbaldehyde	384.63
sulfolane	489.72
2,2,4-trimethylpentane	9.78
2-methyltetrahydrofuran	308.5
n-hexyl acetate	161.86
isooctane	9.09
2-(2-butoxyethoxy)ethanol	168.31
sec-butyl acetate	110.49
tert-butyl acetate	152.32
decalin	16.46
glycerin	197.86
diglyme	333.06
acrylic acid	245.88
isopropyl myristate	62.92
n-butyric acid	259.09
acetyl acetate	189.96
di(2-ethylhexyl) phthalate	66.54
ethyl propionate	160.6
nitromethane	675.82
1,2-diethoxyethane	147.64
benzonitrile	260.27
trioctyl phosphate	50.92
1-bromopropane	207.95
gamma-valerolactone	529.52
n-decanol	60.7
triethyl phosphate	64.77
4-methyl-2-pentanol	75.72
propionitrile	296.51
vinylene carbonate	335.34
1,1,2-trichlorotrifluoroethane	414.95
DMS	163.44
cumene	59.83
2-octanol	64.22
2-hexanone	161.05
octyl acetate	82.31
limonene	62.96
1,2-dimethoxyethane	416.26
ethyl orthosilicate	58.53
tributyl phosphate	52.4
diacetone alcohol	195.97
N,N-dimethylaniline	114.94
acrylonitrile	430.62
aniline	197.13
1,3-propanediol	297.31
bromobenzene	275.48
dibromomethane	593.46
1,1,2,2-tetrachloroethane	657.12
2-methyl-cyclohexyl acetate	99.81
tetrabutyl urea	72.94
diisobutyl methanol	48.77
2-phenylethanol	162.14
styrene	114.09
dioctyl adipate	85.21
dimethyl sulfate	233.47
ethyl butyrate	108.91
methyl lactate	145.14
butyl lactate	89.76
diethyl carbonate	90.94
propanediol butyl ether	131.58
triethyl orthoformate	77.02
p-tert-butyltoluene	48.42
methyl 4-tert-butylbenzoate	137.18
morpholine	463.71
tert-butylamine	119.49
n-dodecanol	48.23
dimethoxymethane	406.31
ethylene carbonate	276.37
cyrene	161.83
2-ethoxyethyl acetate	165.54
2-ethylhexyl acetate	97.84
1,2,4-trichlorobenzene	251.73
4-methylpyridine	329.99
dibutyl ether	76.9
2,6-dimethyl-4-heptanol	48.77
DEF	234.03
dimethyl isosorbide	192.93
tetrachloroethylene	517.81
eugenol	141.54
triacetin	146.86
span 80	94.78
1,4-butanediol	151.65
1,1-dichloroethane	476.69
2-methyl-1-pentanol	125.81
methyl formate	418.29
2-methyl-1-butanol	138.01
n-decane	14.72
butyronitrile	266.31
3,7-dimethyl-1-octanol	75.07
1-chlorooctane	65.05
1-chlorotetradecane	30.21
n-nonane	13.07
undecane	12.21
tert-butylcyclohexane	15.12
cyclooctane	9.28
cyclopentanol	197.84
tetrahydropyran	320.39
tert-amyl methyl ether	108.74
2,5,8-trioxanonane	211.99
1-hexene	44.17
2-isopropoxyethanol	206.0
2,2,2-trifluoroethanol	181.37
methyl butyrate	210.07

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