2-tert-Butyl-5-methyl-2-propyltetrahydrofuran
-
Identifiers
Molecular formula
C12H24OSMILES
CCCC1(CCC(O1)C)C(C)(C)C
-
Odor profile
Fragrance Green 84.65% Fruity 70.73% Mint 57.38% Herbal 56.7% Fresh 52.65% Sweet 49.31% Woody 41.97% Camphoreous 38.17% Cooling 37.53% Earthy 35.59% Flavor Green 67.06% Earthy 39.63% Herbal 34.47% Woody 30.46% Minty 29.69% Camphor 26.89% Pepper 26.28% Spice 23.88% Spicy 22.3% Tea 22.21% Odor impact est.
High -
Properties
XLogP3-AA
3.9pKa est.
9.26 (weak base)Molecular weight
184.32 g/molVapor pressure est.
- hPa @ 20°C
- hPa @ 25°C
Evaporation rate
Moderately fastBoiling point est.
214°CFlash point
- 64.93 ˚C est.
-
Synonyms
- SCHEMBL4468863
- JJNUWXRAXGKBHA-UHFFFAOYSA-N
- 2-tert-Butyl-5-methyl-2-propyltetrahydrofuran
-
Applications
2-tert-Butyl-5-methyl-2-propyltetrahydrofuran is typically employed as an intermediate in the synthesis of complex organic compounds, particularly in pharmaceutical and polymer applications. It can function as a specialty solvent or reaction medium due to its bulky ether framework, suitable for reactions requiring moderate polarity. It may serve as a building block for specialized polymers or as a precursor to coatings-related derivatives and surface-active materials. In coatings, inks, and broader industrial manufacturing, it can be used as a solvent or processing aid to adjust viscosity and volatilization properties. Its use is subject to local regulations and formulation limits.
gpt-5-nano
-
Solubility @25˚C
Solvent Solubility (g/L) ethanol 1353.34 methanol 1210.19 isopropanol 1683.71 water 3.89 ethyl acetate 2254.58 n-propanol 1887.6 acetone 2026.98 n-butanol 1984.36 acetonitrile 1840.36 DMF 2268.86 toluene 3045.27 isobutanol 1959.71 1,4-dioxane 3336.76 methyl acetate 1927.56 THF 5012.25 2-butanone 2292.28 n-pentanol 1540.55 sec-butanol 2105.09 n-hexane 1765.68 ethylene glycol 298.23 NMP 2766.73 cyclohexane 2546.95 DMSO 1236.53 n-butyl acetate 2981.47 n-octanol 2312.26 chloroform 7862.57 n-propyl acetate 1719.12 acetic acid 924.65 dichloromethane 5803.51 cyclohexanone 4535.33 propylene glycol 563.36 isopropyl acetate 1956.3 DMAc 2336.56 2-ethoxyethanol 1307.98 isopentanol 2065.73 n-heptane 2008.4 ethyl formate 1439.77 1,2-dichloroethane 3126.77 n-hexanol 3055.43 2-methoxyethanol 1692.57 isobutyl acetate 1601.76 tetrachloromethane 2513.57 n-pentyl acetate 2229.1 transcutol 2781.97 n-heptanol 1941.64 ethylbenzene 2050.28 MIBK 1919.01 2-propoxyethanol 2424.57 tert-butanol 2330.84 MTBE 3104.12 2-butoxyethanol 1725.26 propionic acid 1326.44 o-xylene 2315.94 formic acid 230.41 diethyl ether 2665.98 m-xylene 2380.02 p-xylene 2661.82 chlorobenzene 3181.51 dimethyl carbonate 791.03 n-octane 827.7 formamide 318.88 cyclopentanone 3760.54 2-pentanone 2234.67 anisole 2314.39 cyclopentyl methyl ether 3732.85 gamma-butyrolactone 3514.04 1-methoxy-2-propanol 1646.23 pyridine 2960.66 3-pentanone 2010.27 furfural 2896.11 n-dodecane 603.13 diethylene glycol 1061.6 diisopropyl ether 1650.77 tert-amyl alcohol 2372.67 acetylacetone 2094.74 n-hexadecane 689.97 acetophenone 1918.53 methyl propionate 1760.4 isopentyl acetate 3067.95 trichloroethylene 5228.89 n-nonanol 1933.47 cyclohexanol 2961.83 benzyl alcohol 1498.05 2-ethylhexanol 2596.44 isooctanol 1676.79 dipropyl ether 2909.58 1,2-dichlorobenzene 3080.16 ethyl lactate 889.63 propylene carbonate 2600.15 n-methylformamide 1059.98 2-pentanol 1800.2 n-pentane 1483.86 1-propoxy-2-propanol 2286.22 1-methoxy-2-propyl acetate 2159.25 2-(2-methoxypropoxy) propanol 1561.81 mesitylene 1885.33 ε-caprolactone 3655.76 p-cymene 1900.47 epichlorohydrin 3584.91 1,1,1-trichloroethane 4811.33 2-aminoethanol 649.47 morpholine-4-carbaldehyde 2765.58 sulfolane 3531.58 2,2,4-trimethylpentane 936.13 2-methyltetrahydrofuran 4350.56 n-hexyl acetate 3371.37 isooctane 799.81 2-(2-butoxyethoxy)ethanol 1717.77 sec-butyl acetate 1538.25 tert-butyl acetate 2134.22 decalin 1408.36 glycerin 600.51 diglyme 3050.97 acrylic acid 976.54 isopropyl myristate 1642.64 n-butyric acid 1925.6 acetyl acetate 1503.03 di(2-ethylhexyl) phthalate 1124.84 ethyl propionate 1797.49 nitromethane 1580.31 1,2-diethoxyethane 1941.46 benzonitrile 2570.02 trioctyl phosphate 1034.2 1-bromopropane 3304.23 gamma-valerolactone 4134.44 n-decanol 1414.64 triethyl phosphate 1071.33 4-methyl-2-pentanol 1379.21 propionitrile 2238.78 vinylene carbonate 2363.42 1,1,2-trichlorotrifluoroethane 2250.09 DMS 1766.98 cumene 1665.47 2-octanol 1790.78 2-hexanone 1981.43 octyl acetate 1862.53 limonene 2656.22 1,2-dimethoxyethane 2768.89 ethyl orthosilicate 1098.51 tributyl phosphate 1095.8 diacetone alcohol 1714.38 N,N-dimethylaniline 1819.8 acrylonitrile 1970.69 aniline 1975.2 1,3-propanediol 932.7 bromobenzene 4032.42 dibromomethane 4722.19 1,1,2,2-tetrachloroethane 5194.43 2-methyl-cyclohexyl acetate 2223.3 tetrabutyl urea 1390.79 diisobutyl methanol 1496.03 2-phenylethanol 2066.15 styrene 2145.49 dioctyl adipate 1675.34 dimethyl sulfate 1073.97 ethyl butyrate 2280.37 methyl lactate 823.22 butyl lactate 1443.17 diethyl carbonate 1510.06 propanediol butyl ether 1513.66 triethyl orthoformate 1817.53 p-tert-butyltoluene 1853.56 methyl 4-tert-butylbenzoate 2128.26 morpholine 3338.97 tert-butylamine 2284.47 n-dodecanol 1122.65 dimethoxymethane 1856.42 ethylene carbonate 2183.26 cyrene 1235.73 2-ethoxyethyl acetate 1869.84 2-ethylhexyl acetate 2782.36 1,2,4-trichlorobenzene 3367.72 4-methylpyridine 3741.82 dibutyl ether 2677.81 2,6-dimethyl-4-heptanol 1496.03 DEF 2276.9 dimethyl isosorbide 2460.78 tetrachloroethylene 3395.64 eugenol 1496.69 triacetin 1928.37 span 80 1695.72 1,4-butanediol 534.4 1,1-dichloroethane 4065.01 2-methyl-1-pentanol 1686.33 methyl formate 926.5 2-methyl-1-butanol 2126.53 n-decane 998.8 butyronitrile 2563.68 3,7-dimethyl-1-octanol 2197.4 1-chlorooctane 2323.93 1-chlorotetradecane 1026.8 n-nonane 1139.98 undecane 743.7 tert-butylcyclohexane 1386.25 cyclooctane 1398.72 cyclopentanol 2644.62 tetrahydropyran 4293.69 tert-amyl methyl ether 2616.38 2,5,8-trioxanonane 1974.86 1-hexene 2627.85 2-isopropoxyethanol 1223.92 2,2,2-trifluoroethanol 482.31 methyl butyrate 2221.81 Scent© AI
| Maximum acceptable concentrations in the finished product (%) | |||
|---|---|---|---|
|
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 |