Cyclohexene, 2-(3-ethoxy-1-buten-1-yl)-1,3,3-trimethyl-
-
Identifiers
Molecular formula
C15H26OSMILES
CCOC(C)/C=C/C1=C(CCCC1(C)C)C
-
Odor profile
Fragrance Fruity 81.67% Woody 79.63% Floral 74.81% Berry 61.88% Raspberry 49.44% Sweet 47.7% Powdery 45.61% Violet 45.21% Tropical 43.77% Orris 39.92% Flavor Floral 68.04% Woody 64.11% Herbal 46.09% Tropical 43.96% Sweet 42.37% Wood 37.92% Citrus 34.79% Fruity 32.07% Spicy 30.49% Violet 29.99% Odor impact est.
Medium -
Properties
XLogP3-AA
3.8pKa est.
8.7 (weak base)Molecular weight
222.37 g/molVapor pressure est.
- hPa @ 20°C
- hPa @ 25°C
Evaporation rate
SlowBoiling point est.
252°CFlash point
- 101.73 ˚C est.
-
Synonyms
- beta-Ionyl ethyl ether
- EINECS 265-765-7
- Cyclohexene, 2-(3-ethoxy-1-butenyl)-1,3,3-trimethyl-
- Cyclohexene, 2-(3-ethoxy-1-buten-1-yl)-1,3,3-trimethyl-
- DTXSID60867151
- SCHEMBL11044895
- DTXCID40815357
- 2-(3-Ethoxybuten-1-yl)-1,3,3-trimethylcyclohexene
-
Applications
Cyclohexene, 2-(3-ethoxy-1-buten-1-yl)-1,3,3-trimethyl- is typically used as a specialty chemical intermediate with several real-world applications: as a building block in fragrance and flavor chemistry for aroma compound synthesis; as a reactive monomer or precursor in specialty polymers and coatings, enabling controlled crosslinking or functionalization; as a co-monomer or crosslinkable component in coatings, inks and adhesives to tune film performance; in cosmetics and personal care as a fragrance-related intermediate or formulation building block; and in pharmaceutical process chemistry or advanced materials development as an intermediate under appropriate regulatory controls. CAS number:
gpt-5-nano
-
Solubility @25˚C
Solvent Solubility (g/L) ethanol 1343.79 methanol 844.71 isopropanol 998.05 water 0.35 ethyl acetate 2215.34 n-propanol 1258.5 acetone 1335.42 n-butanol 1494.78 acetonitrile 864.75 DMF 935.17 toluene 1887.91 isobutanol 958.54 1,4-dioxane 3448.03 methyl acetate 1275.33 THF 3574.43 2-butanone 1404.88 n-pentanol 773.72 sec-butanol 998.22 n-hexane 708.85 ethylene glycol 83.03 NMP 1245.68 cyclohexane 1558.05 DMSO 660.33 n-butyl acetate 2291.13 n-octanol 587.58 chloroform 3942.94 n-propyl acetate 1017.33 acetic acid 668.77 dichloromethane 3475.63 cyclohexanone 2394.78 propylene glycol 160.86 isopropyl acetate 1523.16 DMAc 1080.71 2-ethoxyethanol 701.76 isopentanol 1273.07 n-heptane 636.67 ethyl formate 714.32 1,2-dichloroethane 2265.84 n-hexanol 1881.25 2-methoxyethanol 1101.63 isobutyl acetate 751.45 tetrachloromethane 935.19 n-pentyl acetate 1009.43 transcutol 3941.08 n-heptanol 595.91 ethylbenzene 667.02 MIBK 941.32 2-propoxyethanol 1802.51 tert-butanol 1218.91 MTBE 2428.28 2-butoxyethanol 757.81 propionic acid 597.73 o-xylene 858.52 formic acid 141.11 diethyl ether 3486.55 m-xylene 1104.21 p-xylene 777.84 chlorobenzene 1625.91 dimethyl carbonate 416.87 n-octane 164.28 formamide 203.97 cyclopentanone 1724.45 2-pentanone 1588.82 anisole 906.47 cyclopentyl methyl ether 2609.6 gamma-butyrolactone 1581.27 1-methoxy-2-propanol 947.44 pyridine 1890.04 3-pentanone 1345.43 furfural 1134.51 n-dodecane 97.77 diethylene glycol 628.9 diisopropyl ether 1168.77 tert-amyl alcohol 1131.62 acetylacetone 1246.9 n-hexadecane 117.42 acetophenone 660.69 methyl propionate 1310.1 isopentyl acetate 1893.76 trichloroethylene 3521.31 n-nonanol 536.32 cyclohexanol 1719.63 benzyl alcohol 539.93 2-ethylhexanol 1166.69 isooctanol 478.09 dipropyl ether 1973.43 1,2-dichlorobenzene 1204.53 ethyl lactate 271.73 propylene carbonate 1041.76 n-methylformamide 400.31 2-pentanol 1086.41 n-pentane 730.21 1-propoxy-2-propanol 1387.99 1-methoxy-2-propyl acetate 1717.76 2-(2-methoxypropoxy) propanol 775.64 mesitylene 683.88 ε-caprolactone 2080.31 p-cymene 547.96 epichlorohydrin 2192.64 1,1,1-trichloroethane 2432.89 2-aminoethanol 270.08 morpholine-4-carbaldehyde 1510.11 sulfolane 1386.26 2,2,4-trimethylpentane 291.27 2-methyltetrahydrofuran 3609.63 n-hexyl acetate 1431.54 isooctane 220.53 2-(2-butoxyethoxy)ethanol 1101.13 sec-butyl acetate 833.06 tert-butyl acetate 1531.52 decalin 422.37 glycerin 188.17 diglyme 1825.66 acrylic acid 368.55 isopropyl myristate 538.04 n-butyric acid 1294.24 acetyl acetate 1159.66 di(2-ethylhexyl) phthalate 396.23 ethyl propionate 959.51 nitromethane 890.88 1,2-diethoxyethane 2320.34 benzonitrile 848.84 trioctyl phosphate 298.74 1-bromopropane 2088.11 gamma-valerolactone 2061.07 n-decanol 385.67 triethyl phosphate 441.32 4-methyl-2-pentanol 612.35 propionitrile 932.74 vinylene carbonate 907.97 1,1,2-trichlorotrifluoroethane 1041.18 DMS 847.51 cumene 439.98 2-octanol 412.4 2-hexanone 891.44 octyl acetate 641.11 limonene 1013.88 1,2-dimethoxyethane 1395.73 ethyl orthosilicate 503.22 tributyl phosphate 413.3 diacetone alcohol 915.42 N,N-dimethylaniline 596.99 acrylonitrile 695.75 aniline 1233.56 1,3-propanediol 542.84 bromobenzene 1989.76 dibromomethane 2618.84 1,1,2,2-tetrachloroethane 2762.96 2-methyl-cyclohexyl acetate 908.64 tetrabutyl urea 460.11 diisobutyl methanol 521.2 2-phenylethanol 869.43 styrene 802.78 dioctyl adipate 639.3 dimethyl sulfate 447.23 ethyl butyrate 1302.74 methyl lactate 300.94 butyl lactate 516.77 diethyl carbonate 720.76 propanediol butyl ether 503.58 triethyl orthoformate 895.99 p-tert-butyltoluene 538.63 methyl 4-tert-butylbenzoate 670.76 morpholine 3388.71 tert-butylamine 1140.21 n-dodecanol 290.18 dimethoxymethane 1374.25 ethylene carbonate 912.9 cyrene 485.39 2-ethoxyethyl acetate 1296.44 2-ethylhexyl acetate 1660.29 1,2,4-trichlorobenzene 1353.25 4-methylpyridine 2076.04 dibutyl ether 1186.33 2,6-dimethyl-4-heptanol 521.2 DEF 1503.48 dimethyl isosorbide 1298.06 tetrachloroethylene 1964.16 eugenol 521.07 triacetin 887.28 span 80 701.81 1,4-butanediol 160.11 1,1-dichloroethane 2248.77 2-methyl-1-pentanol 777.3 methyl formate 318.3 2-methyl-1-butanol 1234.33 n-decane 196.73 butyronitrile 1265.01 3,7-dimethyl-1-octanol 635.99 1-chlorooctane 667.62 1-chlorotetradecane 239.64 n-nonane 211.93 undecane 130.63 tert-butylcyclohexane 367.56 cyclooctane 594.65 cyclopentanol 1014.66 tetrahydropyran 4881.67 tert-amyl methyl ether 1673.82 2,5,8-trioxanonane 1182.89 1-hexene 1224.66 2-isopropoxyethanol 615.09 2,2,2-trifluoroethanol 194.23 methyl butyrate 1076.74 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 |