Isobutylather
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Identifiers
Molecular formula
C8H18OSMILES
CCOC(C)CC(C)C
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Odor profile
Fragrance Green 82.15% Ethereal 71.6% Fruity 69.12% Alcoholic 56.27% Fermented 53.81% Fresh 45.89% Herbal 43.28% Cognac 38.66% Pungent 37.19% Cocoa 36.85% Flavor Green 41.16% Ethereal 37.22% Fruity 31.8% Fermented 27.94% Oily 26.68% Fresh 26.02% Fishy 23.9% Tropical 23.59% Yeasty 22.79% Earthy 22.47% Odor impact est.
High -
Properties
XLogP3-AA
2.6pKa est.
8.56 (weak base)Molecular weight
130.23 g/molVapor pressure est.
- hPa @ 20°C
- hPa @ 25°C
Evaporation rate
Ultra fastBoiling point est.
124°CFlash point
- 14.06 ˚C est.
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Synonyms
- Isobutylather
- SCHEMBL12124909
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Applications
Isobutylather is primarily used as a nonpolar solvent in industrial manufacturing and chemical synthesis, serving as a solvent for coatings, inks, and adhesives to improve solubility and processability; it also commonly functions as an intermediate in the preparation of other chemicals, and may be employed as a cleaning and maintenance solvent in production processes, with potential to act as a reactive solvent in polymerization steps to optimize material properties due to its ether-like, low-polarity nature.
gpt-5-nano
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Solubility @25˚C
Solvent Solubility (g/L) ethanol 2912.54 methanol 2582.77 isopropanol 2402.39 water 2.77 ethyl acetate 1251.5 n-propanol 2382.56 acetone 1223.67 n-butanol 2500.26 acetonitrile 1172.71 DMF 738.71 toluene 964.18 isobutanol 1893.72 1,4-dioxane 2777.95 methyl acetate 1000.99 THF 3658.33 2-butanone 1141.55 n-pentanol 1596.18 sec-butanol 2418.98 n-hexane 2623.33 ethylene glycol 376.68 NMP 1061.55 cyclohexane 3522.32 DMSO 865.12 n-butyl acetate 1892.35 n-octanol 1425.73 chloroform 4724.62 n-propyl acetate 839.73 acetic acid 1552.52 dichloromethane 2993.0 cyclohexanone 2379.0 propylene glycol 696.6 isopropyl acetate 787.51 DMAc 723.18 2-ethoxyethanol 1030.19 isopentanol 1894.99 n-heptane 3155.24 ethyl formate 798.2 1,2-dichloroethane 1442.27 n-hexanol 3932.76 2-methoxyethanol 1565.61 isobutyl acetate 584.34 tetrachloromethane 1366.66 n-pentyl acetate 979.52 transcutol 2431.9 n-heptanol 1298.17 ethylbenzene 598.28 MIBK 623.79 2-propoxyethanol 2360.09 tert-butanol 2729.58 MTBE 2122.37 2-butoxyethanol 1050.49 propionic acid 1252.09 o-xylene 620.76 formic acid 366.41 diethyl ether 2399.36 m-xylene 624.34 p-xylene 773.73 chlorobenzene 1037.94 dimethyl carbonate 176.86 n-octane 646.55 formamide 271.23 cyclopentanone 1581.21 2-pentanone 1031.08 anisole 646.07 cyclopentyl methyl ether 2140.4 gamma-butyrolactone 1457.86 1-methoxy-2-propanol 1210.25 pyridine 1611.34 3-pentanone 824.64 furfural 1055.88 n-dodecane 340.54 diethylene glycol 1076.34 diisopropyl ether 815.05 tert-amyl alcohol 2331.43 acetylacetone 654.98 n-hexadecane 374.18 acetophenone 473.98 methyl propionate 708.54 isopentyl acetate 1509.28 trichloroethylene 2153.48 n-nonanol 1113.69 cyclohexanol 3007.72 benzyl alcohol 582.93 2-ethylhexanol 2436.38 isooctanol 934.86 dipropyl ether 2530.0 1,2-dichlorobenzene 839.39 ethyl lactate 324.57 propylene carbonate 961.53 n-methylformamide 539.97 2-pentanol 1738.82 n-pentane 1984.73 1-propoxy-2-propanol 1989.02 1-methoxy-2-propyl acetate 963.67 2-(2-methoxypropoxy) propanol 741.22 mesitylene 428.36 ε-caprolactone 1862.57 p-cymene 704.68 epichlorohydrin 1590.38 1,1,1-trichloroethane 2002.94 2-aminoethanol 864.6 morpholine-4-carbaldehyde 1113.23 sulfolane 1325.26 2,2,4-trimethylpentane 609.43 2-methyltetrahydrofuran 3467.53 n-hexyl acetate 1470.57 isooctane 431.0 2-(2-butoxyethoxy)ethanol 1029.16 sec-butyl acetate 592.49 tert-butyl acetate 802.14 decalin 795.92 glycerin 641.53 diglyme 1554.79 acrylic acid 766.68 isopropyl myristate 588.78 n-butyric acid 1982.78 acetyl acetate 641.3 di(2-ethylhexyl) phthalate 455.85 ethyl propionate 624.28 nitromethane 1015.76 1,2-diethoxyethane 1343.93 benzonitrile 878.53 trioctyl phosphate 389.89 1-bromopropane 2077.8 gamma-valerolactone 1731.14 n-decanol 785.83 triethyl phosphate 413.23 4-methyl-2-pentanol 841.09 propionitrile 1267.17 vinylene carbonate 786.72 1,1,2-trichlorotrifluoroethane 1205.56 DMS 505.23 cumene 448.15 2-octanol 994.56 2-hexanone 993.06 octyl acetate 719.37 limonene 1471.73 1,2-dimethoxyethane 1779.04 ethyl orthosilicate 487.81 tributyl phosphate 464.0 diacetone alcohol 765.23 N,N-dimethylaniline 475.42 acrylonitrile 918.96 aniline 890.49 1,3-propanediol 1222.77 bromobenzene 1114.83 dibromomethane 2829.87 1,1,2,2-tetrachloroethane 2195.67 2-methyl-cyclohexyl acetate 923.87 tetrabutyl urea 558.33 diisobutyl methanol 994.46 2-phenylethanol 935.35 styrene 674.66 dioctyl adipate 678.85 dimethyl sulfate 221.56 ethyl butyrate 1098.09 methyl lactate 324.01 butyl lactate 628.82 diethyl carbonate 586.69 propanediol butyl ether 880.65 triethyl orthoformate 895.89 p-tert-butyltoluene 658.02 methyl 4-tert-butylbenzoate 593.48 morpholine 2955.58 tert-butylamine 2480.48 n-dodecanol 606.0 dimethoxymethane 669.12 ethylene carbonate 801.74 cyrene 476.87 2-ethoxyethyl acetate 776.93 2-ethylhexyl acetate 1367.08 1,2,4-trichlorobenzene 938.68 4-methylpyridine 1479.83 dibutyl ether 1634.4 2,6-dimethyl-4-heptanol 994.46 DEF 917.78 dimethyl isosorbide 1049.84 tetrachloroethylene 1586.3 eugenol 495.15 triacetin 799.68 span 80 1012.36 1,4-butanediol 500.44 1,1-dichloroethane 1960.36 2-methyl-1-pentanol 1329.38 methyl formate 375.18 2-methyl-1-butanol 1947.74 n-decane 630.96 butyronitrile 1718.49 3,7-dimethyl-1-octanol 1203.88 1-chlorooctane 1146.82 1-chlorotetradecane 445.08 n-nonane 777.75 undecane 439.63 tert-butylcyclohexane 786.96 cyclooctane 1103.7 cyclopentanol 2406.45 tetrahydropyran 4508.33 tert-amyl methyl ether 1529.13 2,5,8-trioxanonane 1044.3 1-hexene 2858.11 2-isopropoxyethanol 796.24 2,2,2-trifluoroethanol 341.23 methyl butyrate 860.06 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 |