Ethyl 3-(furan-2-yl)oxirane-2-carboxylate
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Identifiers
Molecular formula
C9H10O4SMILES
CCOC(=O)C1C(O1)C2=CC=CO2
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Odor profile
Fragrance Fruity 91.68% Sweet 61.27% Caramellic 56.38% Berry 52.31% Tropical 41.37% Floral 40.69% Strawberry 40.36% Pineapple 33.48% Winey 30.83% Green 30.23% Flavor Bitter 61.59% Fruity 33.34% Sweet-like 21.17% Mushroom 21.07% Fatty 20.36% Odorless 19.87% Orange flower 19.81% Toffee 19.78% Mildew 19.76% Grape 19.76% Odor impact est.
Medium -
Properties
XLogP3-AA
0.8pKa est.
5.11 (weak acid)Molecular weight
182.17 g/molVapor pressure est.
- hPa @ 20°C
- hPa @ 25°C
Evaporation rate
SlowBoiling point est.
254°CFlash point
- 117.33 ˚C est.
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Synonyms
- AKOS006282373
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Applications
Ethyl 3-(furan-2-yl)oxirane-2-carboxylate serves as a versatile reactive intermediate in organic synthesis, commonly used as a building block for pharmaceutical and agrochemical compounds; it can also function as a monomer or epoxy-functional precursor in epoxy resin formulations for coatings, adhesives, and composites; the glycidyl ester motif enables access to glycidyl-ester–based polymers such as polyesters and polyethers; its furan substitution provides a route to specialty chemicals bearing furan rings; in electronics, it may be used in epoxy-based encapsulants and protective coatings for printed circuit boards and components.
gpt-5-nano
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Solubility @25˚C
Solvent Solubility (g/L) ethanol 41.19 methanol 89.45 isopropanol 23.54 water 0.53 ethyl acetate 103.2 n-propanol 25.57 acetone 156.46 n-butanol 25.83 acetonitrile 135.52 DMF 236.21 toluene 51.07 isobutanol 20.92 1,4-dioxane 158.02 methyl acetate 127.13 THF 183.09 2-butanone 101.89 n-pentanol 25.35 sec-butanol 24.07 n-hexane 1.42 ethylene glycol 40.34 NMP 199.89 cyclohexane 5.66 DMSO 378.11 n-butyl acetate 52.91 n-octanol 11.32 chloroform 200.45 n-propyl acetate 65.68 acetic acid 147.67 dichloromethane 319.16 cyclohexanone 119.5 propylene glycol 19.65 isopropyl acetate 67.11 DMAc 317.12 2-ethoxyethanol 119.15 isopentanol 35.59 n-heptane 1.86 ethyl formate 64.96 1,2-dichloroethane 195.1 n-hexanol 21.42 2-methoxyethanol 188.01 isobutyl acetate 42.01 tetrachloromethane 16.48 n-pentyl acetate 25.26 transcutol 306.63 n-heptanol 11.63 ethylbenzene 26.56 MIBK 56.27 2-propoxyethanol 74.04 tert-butanol 49.89 MTBE 58.74 2-butoxyethanol 43.57 propionic acid 51.61 o-xylene 35.84 formic acid 114.95 diethyl ether 51.79 m-xylene 29.37 p-xylene 37.05 chlorobenzene 80.39 dimethyl carbonate 74.47 n-octane 0.94 formamide 234.34 cyclopentanone 149.29 2-pentanone 72.43 anisole 82.69 cyclopentyl methyl ether 63.85 gamma-butyrolactone 199.85 1-methoxy-2-propanol 91.17 pyridine 190.88 3-pentanone 66.84 furfural 245.99 n-dodecane 1.42 diethylene glycol 106.06 diisopropyl ether 17.65 tert-amyl alcohol 47.64 acetylacetone 159.37 n-hexadecane 1.7 acetophenone 91.04 methyl propionate 90.61 isopentyl acetate 53.67 trichloroethylene 370.9 n-nonanol 12.73 cyclohexanol 35.69 benzyl alcohol 71.9 2-ethylhexanol 18.56 isooctanol 12.13 dipropyl ether 20.24 1,2-dichlorobenzene 81.46 ethyl lactate 40.59 propylene carbonate 96.29 n-methylformamide 107.56 2-pentanol 19.46 n-pentane 1.63 1-propoxy-2-propanol 42.3 1-methoxy-2-propyl acetate 72.45 2-(2-methoxypropoxy) propanol 74.47 mesitylene 19.92 ε-caprolactone 103.11 p-cymene 17.79 epichlorohydrin 278.46 1,1,1-trichloroethane 99.48 2-aminoethanol 43.55 morpholine-4-carbaldehyde 235.47 sulfolane 228.73 2,2,4-trimethylpentane 2.99 2-methyltetrahydrofuran 102.55 n-hexyl acetate 36.03 isooctane 1.77 2-(2-butoxyethoxy)ethanol 82.46 sec-butyl acetate 49.42 tert-butyl acetate 71.29 decalin 4.93 glycerin 55.49 diglyme 181.8 acrylic acid 74.37 isopropyl myristate 19.8 n-butyric acid 62.93 acetyl acetate 102.34 di(2-ethylhexyl) phthalate 25.49 ethyl propionate 62.89 nitromethane 347.71 1,2-diethoxyethane 72.52 benzonitrile 89.27 trioctyl phosphate 14.1 1-bromopropane 48.43 gamma-valerolactone 203.11 n-decanol 10.43 triethyl phosphate 34.76 4-methyl-2-pentanol 18.39 propionitrile 69.22 vinylene carbonate 100.26 1,1,2-trichlorotrifluoroethane 185.09 DMS 73.66 cumene 19.57 2-octanol 8.09 2-hexanone 52.06 octyl acetate 22.41 limonene 23.04 1,2-dimethoxyethane 184.18 ethyl orthosilicate 29.77 tributyl phosphate 20.63 diacetone alcohol 83.53 N,N-dimethylaniline 56.46 acrylonitrile 123.98 aniline 67.55 1,3-propanediol 63.02 bromobenzene 87.62 dibromomethane 144.98 1,1,2,2-tetrachloroethane 196.0 2-methyl-cyclohexyl acetate 45.23 tetrabutyl urea 30.88 diisobutyl methanol 14.96 2-phenylethanol 51.47 styrene 38.66 dioctyl adipate 35.81 dimethyl sulfate 129.32 ethyl butyrate 48.67 methyl lactate 56.92 butyl lactate 25.0 diethyl carbonate 45.71 propanediol butyl ether 35.73 triethyl orthoformate 36.61 p-tert-butyltoluene 16.03 methyl 4-tert-butylbenzoate 59.09 morpholine 148.17 tert-butylamine 26.06 n-dodecanol 8.88 dimethoxymethane 145.45 ethylene carbonate 77.98 cyrene 82.11 2-ethoxyethyl acetate 56.65 2-ethylhexyl acetate 42.57 1,2,4-trichlorobenzene 103.47 4-methylpyridine 137.89 dibutyl ether 20.57 2,6-dimethyl-4-heptanol 14.96 DEF 112.79 dimethyl isosorbide 113.96 tetrachloroethylene 139.62 eugenol 57.75 triacetin 69.4 span 80 40.39 1,4-butanediol 29.02 1,1-dichloroethane 101.7 2-methyl-1-pentanol 33.69 methyl formate 103.54 2-methyl-1-butanol 29.12 n-decane 1.79 butyronitrile 51.1 3,7-dimethyl-1-octanol 18.23 1-chlorooctane 9.37 1-chlorotetradecane 5.75 n-nonane 1.35 undecane 1.58 tert-butylcyclohexane 3.73 cyclooctane 2.23 cyclopentanol 36.72 tetrahydropyran 79.31 tert-amyl methyl ether 48.42 2,5,8-trioxanonane 138.72 1-hexene 7.83 2-isopropoxyethanol 69.41 2,2,2-trifluoroethanol 73.59 methyl butyrate 76.58 Scent© AI
| Maximum acceptable concentrations in the finished product (%) | |||
|---|---|---|---|
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Category 1
Products applied to the lips
|
No restriction |
Category 7A
Rinse-off products applied to the hair with some hand contact
|
No restriction |
|
Category 2
Products applied to the axillae
|
No restriction |
Category 7B
Leave-on products applied to the hair with some hand contact
|
No restriction |
|
Category 3
Products applied to the face/body using fingertips
|
No restriction |
Category 8
Products with significant anogenital exposure
|
No restriction |
|
Category 4
Products related to fine fragrance
|
No restriction |
Category 9
Products with body and hand exposure, primarily rinse off
|
No restriction |
|
Category 5A
Body lotion products applied to the body using the hands (palms), primarily leave on
|
No restriction |
Category 10A
Household care products with mostly hand contact
|
No restriction |
|
Category 5B
Face moisturizer products applied to the face using the hands (palms), primarily leave on
|
No restriction |
Category 10B
Household care products with mostly hand contact, including aerosol/spray products (with potential leave-on skin contact)
|
No restriction |
|
Category 5C
Hand cream products applied to the hands using the hands (palms), primarily leave on
|
No restriction |
Category 11A
Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate without UV exposure
|
No restriction |
|
Category 5D
Baby Creams, baby Oils and baby talc
|
No restriction |
Category 11B
Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate with potential UV exposure
|
No restriction |
|
Category 6
Products with oral and lip exposure
|
No restriction |
Category 12
Products not intended for direct skin contact, minimal or insignificant transfer to skin
|
No restriction |