3-Methyl-3-vinyl-dihydro-furan-2-one
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Identifiers
Molecular formula
C7H10O2SMILES
CC1(CCOC1=O)C=C
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Odor profile
Fragrance Mint 48.44% Sweet 43.77% Herbal 43.16% Spicy 39.52% Tobacco 34.99% Fruity 34.91% Caramellic 34.69% Nutty 32.25% Burnt 31.88% Coumarinic 29.04% Flavor Fruity 50.63% Minty 45.31% Herbal 31.44% Caramel 29.09% Sweet 28.3% Tobacco 26.5% Spice 23.25% Floral 23.06% Woody 22.3% Mint 21.96% Odor impact est.
Medium -
Properties
XLogP3-AA
1.4pKa est.
7.13 (neutral)Molecular weight
126.15 g/molVapor pressure est.
- hPa @ 20°C
- hPa @ 25°C
Evaporation rate
Moderately fastBoiling point est.
191°CFlash point
- 68.27 ˚C est.
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Synonyms
- SCHEMBL15448137
- OOYNHRHZUXAHSV-UHFFFAOYSA-N
- 3-Methyl-3-vinyl-dihydro-furan-2-one
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Applications
3-Methyl-3-vinyl-dihydro-furan-2-one; CAS number: is primarily an organic synthesis intermediate that can serve as a reactive gamma-lactone building block for specialty polymers and plastics, with potential as a monomer or comonomer in polymer networks. In coatings and inks, it may function as a reactive diluent or crosslinkable component to enable formulation of various polymer systems. In fragrance chemistry, gamma-lactone derivatives are used as aroma ingredients, and this compound may be evaluated as a fragrance intermediate. In cosmetics and personal care, it could be used as a fragrance intermediate or synthetic building block in formulations. In household products, it may be incorporated as a fragrance component or as a compound that participates in polymerization in cleaning and hygiene product formulations.
gpt-5-nano
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Solubility @25˚C
Solvent Solubility (g/L) ethanol 295.35 methanol 424.25 isopropanol 203.04 water 12.2 ethyl acetate 254.26 n-propanol 208.5 acetone 214.46 n-butanol 199.87 acetonitrile 234.61 DMF 307.94 toluene 106.04 isobutanol 166.3 1,4-dioxane 430.72 methyl acetate 227.11 THF 423.73 2-butanone 207.93 n-pentanol 172.72 sec-butanol 176.28 n-hexane 13.46 ethylene glycol 78.84 NMP 213.56 cyclohexane 15.08 DMSO 244.56 n-butyl acetate 121.06 n-octanol 78.27 chloroform 569.82 n-propyl acetate 141.8 acetic acid 298.33 dichloromethane 495.75 cyclohexanone 216.39 propylene glycol 75.0 isopropyl acetate 163.56 DMAc 256.91 2-ethoxyethanol 319.64 isopentanol 209.63 n-heptane 9.13 ethyl formate 154.65 1,2-dichloroethane 263.24 n-hexanol 135.26 2-methoxyethanol 403.07 isobutyl acetate 97.15 tetrachloromethane 114.63 n-pentyl acetate 97.95 transcutol 913.03 n-heptanol 82.75 ethylbenzene 72.15 MIBK 172.03 2-propoxyethanol 248.92 tert-butanol 283.88 MTBE 218.52 2-butoxyethanol 162.55 propionic acid 190.13 o-xylene 92.58 formic acid 268.46 diethyl ether 216.85 m-xylene 104.52 p-xylene 112.86 chlorobenzene 156.15 dimethyl carbonate 101.9 n-octane 6.05 formamide 374.74 cyclopentanone 252.57 2-pentanone 185.57 anisole 200.11 cyclopentyl methyl ether 179.5 gamma-butyrolactone 315.33 1-methoxy-2-propanol 277.21 pyridine 240.62 3-pentanone 132.33 furfural 335.24 n-dodecane 6.17 diethylene glycol 218.64 diisopropyl ether 83.68 tert-amyl alcohol 229.27 acetylacetone 244.15 n-hexadecane 7.03 acetophenone 184.28 methyl propionate 173.36 isopentyl acetate 133.88 trichloroethylene 526.08 n-nonanol 74.17 cyclohexanol 137.74 benzyl alcohol 153.08 2-ethylhexanol 80.28 isooctanol 79.43 dipropyl ether 73.31 1,2-dichlorobenzene 172.91 ethyl lactate 80.32 propylene carbonate 184.37 n-methylformamide 241.57 2-pentanol 154.14 n-pentane 14.76 1-propoxy-2-propanol 147.13 1-methoxy-2-propyl acetate 165.45 2-(2-methoxypropoxy) propanol 191.93 mesitylene 75.8 ε-caprolactone 215.49 p-cymene 49.35 epichlorohydrin 393.89 1,1,1-trichloroethane 300.65 2-aminoethanol 163.81 morpholine-4-carbaldehyde 372.13 sulfolane 287.19 2,2,4-trimethylpentane 16.0 2-methyltetrahydrofuran 255.09 n-hexyl acetate 142.2 isooctane 16.1 2-(2-butoxyethoxy)ethanol 263.06 sec-butyl acetate 116.75 tert-butyl acetate 213.23 decalin 18.12 glycerin 126.06 diglyme 425.41 acrylic acid 172.94 isopropyl myristate 63.76 n-butyric acid 229.26 acetyl acetate 164.94 di(2-ethylhexyl) phthalate 67.54 ethyl propionate 128.57 nitromethane 447.97 1,2-diethoxyethane 227.85 benzonitrile 168.8 trioctyl phosphate 44.28 1-bromopropane 133.95 gamma-valerolactone 351.9 n-decanol 53.92 triethyl phosphate 63.93 4-methyl-2-pentanol 120.79 propionitrile 175.7 vinylene carbonate 193.31 1,1,2-trichlorotrifluoroethane 249.39 DMS 132.96 cumene 64.76 2-octanol 58.15 2-hexanone 140.07 octyl acetate 75.51 limonene 59.44 1,2-dimethoxyethane 366.9 ethyl orthosilicate 66.96 tributyl phosphate 59.51 diacetone alcohol 227.91 N,N-dimethylaniline 137.65 acrylonitrile 228.48 aniline 155.99 1,3-propanediol 227.1 bromobenzene 155.26 dibromomethane 289.14 1,1,2,2-tetrachloroethane 376.53 2-methyl-cyclohexyl acetate 107.25 tetrabutyl urea 67.61 diisobutyl methanol 62.11 2-phenylethanol 144.44 styrene 88.71 dioctyl adipate 89.09 dimethyl sulfate 139.81 ethyl butyrate 106.76 methyl lactate 92.24 butyl lactate 83.72 diethyl carbonate 83.39 propanediol butyl ether 146.5 triethyl orthoformate 84.81 p-tert-butyltoluene 50.53 methyl 4-tert-butylbenzoate 153.61 morpholine 418.38 tert-butylamine 176.32 n-dodecanol 40.57 dimethoxymethane 286.43 ethylene carbonate 153.75 cyrene 166.82 2-ethoxyethyl acetate 161.56 2-ethylhexyl acetate 100.36 1,2,4-trichlorobenzene 195.38 4-methylpyridine 248.87 dibutyl ether 77.89 2,6-dimethyl-4-heptanol 62.11 DEF 191.82 dimethyl isosorbide 271.92 tetrachloroethylene 281.96 eugenol 151.29 triacetin 150.67 span 80 135.38 1,4-butanediol 108.56 1,1-dichloroethane 283.96 2-methyl-1-pentanol 175.03 methyl formate 172.52 2-methyl-1-butanol 177.32 n-decane 9.91 butyronitrile 164.58 3,7-dimethyl-1-octanol 90.93 1-chlorooctane 42.66 1-chlorotetradecane 19.14 n-nonane 8.56 undecane 7.53 tert-butylcyclohexane 20.58 cyclooctane 7.57 cyclopentanol 136.88 tetrahydropyran 242.04 tert-amyl methyl ether 160.49 2,5,8-trioxanonane 308.47 1-hexene 54.71 2-isopropoxyethanol 218.77 2,2,2-trifluoroethanol 158.52 methyl butyrate 156.4 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 |