2-methoxy-4-prop-2-enylphenol;[(E)-prop-1-enyl]benzene
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Identifiers
Molecular formula
C19H22O2SMILES
C/C=C/C1=CC=CC=C1.COC1=C(C=CC(=C1)CC=C)O
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Odor profile
Fragrance Sweet 71.59% Green 54.21% Spicy 46.09% Herbal 44.7% Balsamic 39.74% Floral 34.51% Anisic 34.0% Nutty 31.64% Cinnamon 30.84% Warm 28.09% Flavor Sweet 72.47% Balsam 51.88% Green 36.68% Anise 36.46% Plastic 32.0% Balsamic 31.51% Licorice 30.84% Spice 29.14% Gasoline 28.03% Spicy 27.89% Odor impact est.
High -
Properties
pKa est.
7.65 (neutral)Molecular weight
282.4 g/molVapor pressure est.
- hPa @ 20°C
- hPa @ 25°C
Evaporation rate
FastBoiling point est.
176°CFlash point
- 51.71 ˚C est.
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Synonyms
- 2-methoxy-4-prop-2-enylphenol;[(E)-prop-1-enyl]benzene
- SCHEMBL16556301
- JKTRXPUEIZZFGE-RPPWHJSFSA-N
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Applications
2-methoxy-4-prop-2-enylphenol;[(E)-prop-1-enyl]benzene is primarily used as an aroma compound and fragrance ingredient, with applications in perfumery and cosmetics; it can serve as an intermediate in the synthesis of more complex aroma molecules and in fragrance formulation; it is also employed in household products such as air fresheners and cleaners as a scent component; in industrial manufacturing it provides a building block for aroma compounds and related fragrance additives used in plastics, coatings, and inks; and it may be evaluated for niche applications requiring controlled scent release.
gpt-5-nano
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Solubility @25˚C
Solvent Solubility (g/L) ethanol 1629.74 methanol 614.38 isopropanol 1421.81 water 0.13 ethyl acetate 2533.9 n-propanol 1423.19 acetone 3371.0 n-butanol 1588.67 acetonitrile 2452.88 DMF 2208.51 toluene 1983.31 isobutanol 1148.02 1,4-dioxane 3800.56 methyl acetate 2034.88 THF 4635.46 2-butanone 2624.63 n-pentanol 959.94 sec-butanol 1303.59 n-hexane 1871.7 ethylene glycol 140.26 NMP 1714.12 cyclohexane 2316.87 DMSO 2595.27 n-butyl acetate 4444.83 n-octanol 942.18 chloroform 4883.79 n-propyl acetate 1581.55 acetic acid 811.53 dichloromethane 5935.9 cyclohexanone 3463.16 propylene glycol 247.71 isopropyl acetate 1161.28 DMAc 1224.61 2-ethoxyethanol 722.82 isopentanol 1147.39 n-heptane 2934.62 ethyl formate 1354.11 1,2-dichloroethane 4096.72 n-hexanol 2479.03 2-methoxyethanol 1161.46 isobutyl acetate 899.99 tetrachloromethane 1210.15 n-pentyl acetate 1069.35 transcutol 2282.96 n-heptanol 827.54 ethylbenzene 1027.36 MIBK 1191.2 2-propoxyethanol 1831.91 tert-butanol 1481.47 MTBE 1811.23 2-butoxyethanol 738.75 propionic acid 903.25 o-xylene 826.9 formic acid 72.97 diethyl ether 3651.68 m-xylene 1067.48 p-xylene 994.64 chlorobenzene 1783.48 dimethyl carbonate 649.13 n-octane 674.72 formamide 210.32 cyclopentanone 3401.29 2-pentanone 2683.78 anisole 1212.39 cyclopentyl methyl ether 2703.05 gamma-butyrolactone 2731.62 1-methoxy-2-propanol 1088.5 pyridine 2755.68 3-pentanone 1992.53 furfural 1480.13 n-dodecane 354.87 diethylene glycol 612.0 diisopropyl ether 1002.42 tert-amyl alcohol 1123.85 acetylacetone 1638.84 n-hexadecane 406.74 acetophenone 849.51 methyl propionate 1817.52 isopentyl acetate 2432.21 trichloroethylene 4704.58 n-nonanol 749.29 cyclohexanol 1684.75 benzyl alcohol 553.65 2-ethylhexanol 1971.03 isooctanol 592.2 dipropyl ether 4641.49 1,2-dichlorobenzene 1222.13 ethyl lactate 378.94 propylene carbonate 1597.65 n-methylformamide 898.76 2-pentanol 1260.53 n-pentane 1455.17 1-propoxy-2-propanol 1779.8 1-methoxy-2-propyl acetate 1540.35 2-(2-methoxypropoxy) propanol 621.1 mesitylene 654.44 ε-caprolactone 2293.01 p-cymene 865.33 epichlorohydrin 3383.4 1,1,1-trichloroethane 3493.21 2-aminoethanol 312.39 morpholine-4-carbaldehyde 1540.1 sulfolane 2831.42 2,2,4-trimethylpentane 310.99 2-methyltetrahydrofuran 4036.96 n-hexyl acetate 1558.56 isooctane 346.8 2-(2-butoxyethoxy)ethanol 863.37 sec-butyl acetate 846.87 tert-butyl acetate 1067.99 decalin 582.7 glycerin 220.6 diglyme 1795.85 acrylic acid 545.15 isopropyl myristate 704.54 n-butyric acid 1571.58 acetyl acetate 1018.87 di(2-ethylhexyl) phthalate 362.0 ethyl propionate 1315.2 nitromethane 1475.48 1,2-diethoxyethane 2398.72 benzonitrile 1067.55 trioctyl phosphate 355.86 1-bromopropane 4115.8 gamma-valerolactone 2295.04 n-decanol 594.82 triethyl phosphate 514.35 4-methyl-2-pentanol 541.1 propionitrile 2006.02 vinylene carbonate 1268.48 1,1,2-trichlorotrifluoroethane 1045.85 DMS 829.17 cumene 552.81 2-octanol 588.06 2-hexanone 1840.63 octyl acetate 824.02 limonene 1699.64 1,2-dimethoxyethane 2117.6 ethyl orthosilicate 526.0 tributyl phosphate 449.1 diacetone alcohol 865.26 N,N-dimethylaniline 734.47 acrylonitrile 1628.16 aniline 1132.3 1,3-propanediol 550.51 bromobenzene 2303.96 dibromomethane 5087.49 1,1,2,2-tetrachloroethane 3330.5 2-methyl-cyclohexyl acetate 965.58 tetrabutyl urea 675.89 diisobutyl methanol 862.15 2-phenylethanol 823.95 styrene 1368.59 dioctyl adipate 732.26 dimethyl sulfate 750.99 ethyl butyrate 2490.66 methyl lactate 405.93 butyl lactate 484.43 diethyl carbonate 1108.85 propanediol butyl ether 522.69 triethyl orthoformate 1125.41 p-tert-butyltoluene 736.45 methyl 4-tert-butylbenzoate 659.06 morpholine 3449.37 tert-butylamine 1219.88 n-dodecanol 511.8 dimethoxymethane 1946.47 ethylene carbonate 1290.01 cyrene 453.71 2-ethoxyethyl acetate 1018.92 2-ethylhexyl acetate 2171.56 1,2,4-trichlorobenzene 1178.92 4-methylpyridine 2515.85 dibutyl ether 2305.65 2,6-dimethyl-4-heptanol 862.15 DEF 2056.78 dimethyl isosorbide 1157.03 tetrachloroethylene 2198.24 eugenol 525.41 triacetin 760.57 span 80 641.24 1,4-butanediol 224.98 1,1-dichloroethane 4132.32 2-methyl-1-pentanol 701.55 methyl formate 754.55 2-methyl-1-butanol 1098.35 n-decane 608.72 butyronitrile 2453.12 3,7-dimethyl-1-octanol 809.03 1-chlorooctane 1358.62 1-chlorotetradecane 545.34 n-nonane 772.48 undecane 451.2 tert-butylcyclohexane 510.96 cyclooctane 920.1 cyclopentanol 1648.12 tetrahydropyran 5189.89 tert-amyl methyl ether 1247.15 2,5,8-trioxanonane 1101.49 1-hexene 3189.27 2-isopropoxyethanol 578.44 2,2,2-trifluoroethanol 179.1 methyl butyrate 1774.23 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 |