Methyl 3-phenylprop-2-enoate
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Identifiers
Molecular formula
C10H10O2SMILES
COC(=O)C=CC1=CC=CC=C1
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Odor profile
Fragrance Sweet 91.03% Fruity 90.56% Balsamic 80.95% Spicy 67.79% Cinnamon 66.51% Cherry 57.44% Floral 56.18% Honey 44.41% Powdery 41.85% Almond 40.7% Flavor Sweet 67.26% Balsam 62.61% Floral 52.58% Cherry 44.25% Honey 39.99% Cinnamon 38.76% Strawberry 35.56% Fruity 33.16% Balsamic 31.87% Anise 29.39% Odor impact est.
High -
Properties
XLogP3-AA
2.6pKa est.
6.42 (neutral)Molecular weight
162.18 g/molVapor pressure est.
- hPa @ 20°C
- hPa @ 25°C
Evaporation rate
SlowBoiling point est.
244°CFlash point
- 114.72 ˚C est.
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Synonyms
- 2-Propenoic acid, 3-phenyl-, methyl ester
- methyl 3-phenylprop-2-enoate
- Monomethylcinnamat
- Methyl ester of Cinnamic acid
- CHEMBL3560502
- AKOS028109958
- SB40769
- DB-014887
- Methyl 3-phenyl propenoate; 3-Phenyl-2-propenoic acid methyl ester
- Methyl E/Z-cinnamate; 3-Phenyl-2-propenoic acid methyl ester; 3-Phenylacrylic acid methyl ester; Methyl 3-phenyl-2-propenoate; Methyl 3-phenacrylate
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Applications
Methyl 3-phenylprop-2-enoate, commonly known as methyl cinnamate, is widely used as a fragrance ingredient in perfumery and cosmetics, imparting sweet, floral, and balsamic notes. It may also serve as a flavor/aroma compound in food and beverage formulations where permitted, contributing fruity or berry-like character. The compound often functions as an intermediate in organic synthesis to prepare cinnamate-based derivatives. In household products, coatings, and inks, it can be used to augment or stabilize fragrance profiles. It is also used as a fragrance ingredient in personal care products and may appear as a flavor-related additive in certain formulations, subject to local regulations and formulation limits.
gpt-5-nano
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Solubility @25˚C
Solvent Solubility (g/L) ethanol 186.29 methanol 206.53 isopropanol 81.96 water 0.17 ethyl acetate 440.99 n-propanol 115.19 acetone 181.64 n-butanol 87.79 acetonitrile 290.18 DMF 413.41 toluene 191.2 isobutanol 62.12 1,4-dioxane 511.62 methyl acetate 348.46 THF 319.77 2-butanone 273.3 n-pentanol 73.3 sec-butanol 87.47 n-hexane 3.09 ethylene glycol 45.86 NMP 247.98 cyclohexane 5.82 DMSO 392.73 n-butyl acetate 146.01 n-octanol 23.38 chloroform 649.22 n-propyl acetate 159.69 acetic acid 169.8 dichloromethane 782.48 cyclohexanone 223.89 propylene glycol 57.03 isopropyl acetate 153.91 DMAc 435.43 2-ethoxyethanol 209.45 isopentanol 83.26 n-heptane 3.17 ethyl formate 129.55 1,2-dichloroethane 548.23 n-hexanol 65.62 2-methoxyethanol 337.7 isobutyl acetate 82.01 tetrachloromethane 34.38 n-pentyl acetate 53.76 transcutol 1052.15 n-heptanol 25.88 ethylbenzene 77.33 MIBK 106.7 2-propoxyethanol 162.94 tert-butanol 126.66 MTBE 145.56 2-butoxyethanol 81.61 propionic acid 142.39 o-xylene 84.85 formic acid 89.25 diethyl ether 248.2 m-xylene 74.1 p-xylene 75.05 chlorobenzene 171.84 dimethyl carbonate 137.59 n-octane 1.38 formamide 266.04 cyclopentanone 270.1 2-pentanone 180.63 anisole 229.35 cyclopentyl methyl ether 147.01 gamma-butyrolactone 365.78 1-methoxy-2-propanol 201.81 pyridine 523.32 3-pentanone 173.55 furfural 370.66 n-dodecane 1.54 diethylene glycol 138.21 diisopropyl ether 39.99 tert-amyl alcohol 121.26 acetylacetone 250.27 n-hexadecane 1.82 acetophenone 178.03 methyl propionate 292.98 isopentyl acetate 124.97 trichloroethylene 1074.63 n-nonanol 23.15 cyclohexanol 62.5 benzyl alcohol 139.35 2-ethylhexanol 46.12 isooctanol 23.61 dipropyl ether 63.84 1,2-dichlorobenzene 154.77 ethyl lactate 64.46 propylene carbonate 170.68 n-methylformamide 226.34 2-pentanol 58.65 n-pentane 2.65 1-propoxy-2-propanol 98.91 1-methoxy-2-propyl acetate 170.25 2-(2-methoxypropoxy) propanol 132.52 mesitylene 36.65 ε-caprolactone 199.78 p-cymene 31.06 epichlorohydrin 655.35 1,1,1-trichloroethane 262.54 2-aminoethanol 90.76 morpholine-4-carbaldehyde 355.68 sulfolane 373.58 2,2,4-trimethylpentane 4.55 2-methyltetrahydrofuran 248.82 n-hexyl acetate 80.84 isooctane 2.96 2-(2-butoxyethoxy)ethanol 178.55 sec-butyl acetate 111.21 tert-butyl acetate 157.27 decalin 8.93 glycerin 99.6 diglyme 412.51 acrylic acid 136.07 isopropyl myristate 33.96 n-butyric acid 150.64 acetyl acetate 192.68 di(2-ethylhexyl) phthalate 38.35 ethyl propionate 171.53 nitromethane 460.82 1,2-diethoxyethane 226.75 benzonitrile 154.38 trioctyl phosphate 21.54 1-bromopropane 185.98 gamma-valerolactone 370.04 n-decanol 17.39 triethyl phosphate 59.27 4-methyl-2-pentanol 37.13 propionitrile 197.33 vinylene carbonate 179.75 1,1,2-trichlorotrifluoroethane 314.69 DMS 134.68 cumene 41.88 2-octanol 15.42 2-hexanone 128.2 octyl acetate 38.95 limonene 40.26 1,2-dimethoxyethane 338.92 ethyl orthosilicate 56.78 tributyl phosphate 33.85 diacetone alcohol 168.19 N,N-dimethylaniline 120.63 acrylonitrile 291.71 aniline 190.0 1,3-propanediol 118.81 bromobenzene 194.13 dibromomethane 402.78 1,1,2,2-tetrachloroethane 690.12 2-methyl-cyclohexyl acetate 83.53 tetrabutyl urea 46.05 diisobutyl methanol 29.0 2-phenylethanol 102.26 styrene 124.0 dioctyl adipate 64.73 dimethyl sulfate 198.06 ethyl butyrate 121.68 methyl lactate 95.51 butyl lactate 47.89 diethyl carbonate 99.92 propanediol butyl ether 77.59 triethyl orthoformate 80.78 p-tert-butyltoluene 29.83 methyl 4-tert-butylbenzoate 98.48 morpholine 518.86 tert-butylamine 65.7 n-dodecanol 13.58 dimethoxymethane 304.86 ethylene carbonate 126.94 cyrene 111.31 2-ethoxyethyl acetate 135.82 2-ethylhexyl acetate 103.12 1,2,4-trichlorobenzene 204.0 4-methylpyridine 367.38 dibutyl ether 52.65 2,6-dimethyl-4-heptanol 29.0 DEF 269.21 dimethyl isosorbide 216.82 tetrachloroethylene 370.97 eugenol 103.46 triacetin 119.19 span 80 78.47 1,4-butanediol 41.14 1,1-dichloroethane 334.76 2-methyl-1-pentanol 79.32 methyl formate 147.62 2-methyl-1-butanol 78.42 n-decane 2.34 butyronitrile 131.63 3,7-dimethyl-1-octanol 34.75 1-chlorooctane 19.36 1-chlorotetradecane 7.97 n-nonane 1.98 undecane 1.86 tert-butylcyclohexane 8.38 cyclooctane 2.27 cyclopentanol 57.89 tetrahydropyran 260.16 tert-amyl methyl ether 117.88 2,5,8-trioxanonane 265.35 1-hexene 32.41 2-isopropoxyethanol 134.36 2,2,2-trifluoroethanol 64.48 methyl butyrate 186.7 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 |