2-Propenoic acid, 3-phenyl-, pentyl ester
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Identifiers
Molecular formula
C14H18O2SMILES
CCCCCOC(=O)/C=C\C1=CC=CC=C1
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Odor profile
Fragrance Balsamic 85.66% Sweet 76.08% Fruity 66.78% Floral 57.74% Spicy 51.66% Cinnamon 46.78% Herbal 45.72% Cocoa 41.08% Honey 40.88% Rose 38.3% Flavor Balsam 49.7% Green 40.54% Floral 38.65% Amber 28.22% Orchid 27.0% Leaf 26.84% Fruity 26.78% Waxy 26.57% Honey 25.64% Chocolate 25.62% Odor impact est.
Medium -
Properties
XLogP3-AA
4.4pKa est.
6.78 (neutral)Molecular weight
218.29 g/molVapor pressure est.
- hPa @ 20°C
- hPa @ 25°C
Evaporation rate
Ultra slowBoiling point est.
307°CFlash point
- 149.49 ˚C est.
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Synonyms
- EINECS 222-478-1
- AI3-24209
- NSC 46140
- 2-Propenoic acid, 3-phenyl-, pentyl ester
- DTXSID7063051
- cis-Amyl cinnamate
- DTXCID5038913
- SCHEMBL17629134
- QDRJCWZGTMRXCL-KHPPLWFESA-N
- Cinnamic acid, pentyl ester (8CI)
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Applications
2-Propenoic acid, 3-phenyl-, pentyl ester is commonly used as a fragrance ingredient and fixative in perfumery and personal care products to help extend the scent; it also serves as a flavor ingredient in certain flavor formulations and can be found in some household and cleaning products where a fragrance note is desired; in addition, it may be employed as an intermediate in the synthesis of other fragrance compounds and cinnamate derivatives. Use is subject to formulation requirements and local regulations.
gpt-5-nano
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Solubility @25˚C
Solvent Solubility (g/L) ethanol 1520.09 methanol 2044.11 isopropanol 550.46 water 0.1 ethyl acetate 2343.57 n-propanol 956.61 acetone 2492.51 n-butanol 773.4 acetonitrile 1797.6 DMF 4322.09 toluene 1158.42 isobutanol 542.46 1,4-dioxane 1510.1 methyl acetate 1543.03 THF 1862.44 2-butanone 2006.6 n-pentanol 483.15 sec-butanol 559.2 n-hexane 69.03 ethylene glycol 145.26 NMP 2262.04 cyclohexane 104.42 DMSO 3747.76 n-butyl acetate 1010.0 n-octanol 116.67 chloroform 4111.88 n-propyl acetate 985.02 acetic acid 924.58 dichloromethane 5506.32 cyclohexanone 2098.04 propylene glycol 222.6 isopropyl acetate 982.85 DMAc 2739.87 2-ethoxyethanol 802.65 isopentanol 611.1 n-heptane 23.69 ethyl formate 698.21 1,2-dichloroethane 4667.81 n-hexanol 439.17 2-methoxyethanol 1521.03 isobutyl acetate 493.34 tetrachloromethane 242.02 n-pentyl acetate 391.83 transcutol 3645.69 n-heptanol 134.37 ethylbenzene 396.35 MIBK 740.5 2-propoxyethanol 864.9 tert-butanol 564.65 MTBE 914.57 2-butoxyethanol 374.65 propionic acid 700.53 o-xylene 405.83 formic acid 273.71 diethyl ether 1725.11 m-xylene 461.89 p-xylene 390.92 chlorobenzene 1442.62 dimethyl carbonate 658.84 n-octane 9.42 formamide 770.19 cyclopentanone 2271.48 2-pentanone 1685.71 anisole 932.35 cyclopentyl methyl ether 1131.46 gamma-butyrolactone 2224.98 1-methoxy-2-propanol 1008.26 pyridine 2735.07 3-pentanone 1346.99 furfural 1671.84 n-dodecane 8.65 diethylene glycol 553.01 diisopropyl ether 283.89 tert-amyl alcohol 535.05 acetylacetone 1729.88 n-hexadecane 10.42 acetophenone 809.86 methyl propionate 1812.76 isopentyl acetate 802.88 trichloroethylene 6829.79 n-nonanol 110.3 cyclohexanol 590.68 benzyl alcohol 585.01 2-ethylhexanol 261.74 isooctanol 116.4 dipropyl ether 397.91 1,2-dichlorobenzene 1159.8 ethyl lactate 287.77 propylene carbonate 1068.44 n-methylformamide 1521.06 2-pentanol 443.96 n-pentane 49.54 1-propoxy-2-propanol 559.78 1-methoxy-2-propyl acetate 845.2 2-(2-methoxypropoxy) propanol 441.35 mesitylene 210.62 ε-caprolactone 1470.32 p-cymene 133.81 epichlorohydrin 3484.87 1,1,1-trichloroethane 2015.88 2-aminoethanol 415.13 morpholine-4-carbaldehyde 1580.29 sulfolane 2523.33 2,2,4-trimethylpentane 31.98 2-methyltetrahydrofuran 1453.37 n-hexyl acetate 509.79 isooctane 24.06 2-(2-butoxyethoxy)ethanol 661.0 sec-butyl acetate 588.32 tert-butyl acetate 827.87 decalin 65.92 glycerin 289.61 diglyme 1384.67 acrylic acid 606.26 isopropyl myristate 160.79 n-butyric acid 1089.9 acetyl acetate 972.47 di(2-ethylhexyl) phthalate 160.3 ethyl propionate 881.73 nitromethane 2523.9 1,2-diethoxyethane 1208.35 benzonitrile 869.64 trioctyl phosphate 99.4 1-bromopropane 2019.21 gamma-valerolactone 2192.35 n-decanol 80.2 triethyl phosphate 227.12 4-methyl-2-pentanol 217.31 propionitrile 1139.63 vinylene carbonate 959.16 1,1,2-trichlorotrifluoroethane 1496.38 DMS 657.91 cumene 188.71 2-octanol 86.01 2-hexanone 919.15 octyl acetate 196.52 limonene 214.51 1,2-dimethoxyethane 1372.81 ethyl orthosilicate 210.52 tributyl phosphate 163.88 diacetone alcohol 716.61 N,N-dimethylaniline 482.1 acrylonitrile 1647.55 aniline 1045.86 1,3-propanediol 569.12 bromobenzene 1757.4 dibromomethane 3405.76 1,1,2,2-tetrachloroethane 5050.24 2-methyl-cyclohexyl acetate 366.95 tetrabutyl urea 225.67 diisobutyl methanol 136.37 2-phenylethanol 476.31 styrene 681.75 dioctyl adipate 271.12 dimethyl sulfate 947.28 ethyl butyrate 630.98 methyl lactate 464.56 butyl lactate 295.38 diethyl carbonate 402.83 propanediol butyl ether 335.3 triethyl orthoformate 324.86 p-tert-butyltoluene 123.57 methyl 4-tert-butylbenzoate 350.77 morpholine 2319.3 tert-butylamine 342.11 n-dodecanol 59.1 dimethoxymethane 1900.89 ethylene carbonate 795.48 cyrene 361.52 2-ethoxyethyl acetate 712.03 2-ethylhexyl acetate 609.64 1,2,4-trichlorobenzene 1348.76 4-methylpyridine 2547.29 dibutyl ether 327.11 2,6-dimethyl-4-heptanol 136.37 DEF 2201.23 dimethyl isosorbide 754.41 tetrachloroethylene 2569.73 eugenol 381.89 triacetin 498.13 span 80 317.85 1,4-butanediol 194.27 1,1-dichloroethane 3135.82 2-methyl-1-pentanol 473.58 methyl formate 861.43 2-methyl-1-butanol 636.08 n-decane 13.93 butyronitrile 1108.38 3,7-dimethyl-1-octanol 174.4 1-chlorooctane 122.58 1-chlorotetradecane 41.61 n-nonane 12.93 undecane 10.44 tert-butylcyclohexane 49.33 cyclooctane 26.85 cyclopentanol 489.26 tetrahydropyran 1846.9 tert-amyl methyl ether 671.69 2,5,8-trioxanonane 844.34 1-hexene 416.75 2-isopropoxyethanol 532.73 2,2,2-trifluoroethanol 230.73 methyl butyrate 1231.3 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 |