Cyclohexyl pent-4-enoate
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Identifiers
Molecular formula
C11H18O2SMILES
C=CCCC(=O)OC1CCCCC1
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Odor profile
Fragrance Fruity 93.63% Pineapple 66.61% Green 61.2% Sweet 55.94% Tropical 42.63% Apple 39.66% Waxy 35.25% Banana 32.77% Peach 31.88% Winey 31.38% Flavor Fruity 57.59% Tropical 33.12% Pineapple 33.08% Floral 26.79% Oily 25.28% Fresh 24.48% Berry 24.4% Fatty 23.82% Fruit 23.05% Sweet 22.27% Odor impact est.
Medium -
Properties
XLogP3-AA
3.0pKa est.
7.3 (neutral)Molecular weight
182.26 g/molVapor pressure est.
- hPa @ 20°C
- hPa @ 25°C
Evaporation rate
Moderately slowBoiling point est.
237°CFlash point
- 102.04 ˚C est.
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Synonyms
- SCHEMBL1378849
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Applications
Cyclohexyl pent-4-enoate can be used as a reactive monomer and crosslinking component in UV-curable coatings, inks, and adhesive formulations; it may serve as a fragrance ingredient and fixative in perfumery and cosmetics; it acts as an intermediate for the synthesis of specialty esters and polymeric materials; it may be evaluated as a plasticizer or processing aid in polymer formulations; and it can appear as an aroma ingredient in household and cleaning products.
gpt-5-nano
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Solubility @25˚C
Solvent Solubility (g/L) ethanol 674.07 methanol 711.71 isopropanol 613.61 water 0.19 ethyl acetate 553.43 n-propanol 539.4 acetone 817.72 n-butanol 561.42 acetonitrile 491.06 DMF 941.14 toluene 330.6 isobutanol 473.06 1,4-dioxane 810.03 methyl acetate 456.85 THF 1190.27 2-butanone 586.05 n-pentanol 429.9 sec-butanol 531.33 n-hexane 132.07 ethylene glycol 71.68 NMP 710.84 cyclohexane 190.64 DMSO 922.73 n-butyl acetate 642.45 n-octanol 257.79 chloroform 2148.74 n-propyl acetate 386.77 acetic acid 584.88 dichloromethane 1615.2 cyclohexanone 983.6 propylene glycol 158.32 isopropyl acetate 389.77 DMAc 720.62 2-ethoxyethanol 368.75 isopentanol 537.91 n-heptane 59.31 ethyl formate 369.4 1,2-dichloroethane 929.09 n-hexanol 523.17 2-methoxyethanol 544.76 isobutyl acetate 282.35 tetrachloromethane 194.92 n-pentyl acetate 345.53 transcutol 1613.69 n-heptanol 205.21 ethylbenzene 233.63 MIBK 358.94 2-propoxyethanol 573.64 tert-butanol 647.39 MTBE 506.17 2-butoxyethanol 324.56 propionic acid 440.73 o-xylene 217.3 formic acid 114.7 diethyl ether 494.18 m-xylene 229.76 p-xylene 306.61 chlorobenzene 613.89 dimethyl carbonate 154.34 n-octane 31.78 formamide 152.47 cyclopentanone 951.86 2-pentanone 510.15 anisole 381.8 cyclopentyl methyl ether 506.36 gamma-butyrolactone 929.84 1-methoxy-2-propanol 479.11 pyridine 933.64 3-pentanone 350.04 furfural 807.86 n-dodecane 30.74 diethylene glycol 339.49 diisopropyl ether 170.03 tert-amyl alcohol 506.94 acetylacetone 539.67 n-hexadecane 35.44 acetophenone 378.97 methyl propionate 354.06 isopentyl acetate 537.15 trichloroethylene 1734.63 n-nonanol 223.58 cyclohexanol 541.08 benzyl alcohol 328.54 2-ethylhexanol 309.34 isooctanol 180.12 dipropyl ether 301.41 1,2-dichlorobenzene 528.29 ethyl lactate 180.34 propylene carbonate 590.12 n-methylformamide 350.29 2-pentanol 423.85 n-pentane 85.16 1-propoxy-2-propanol 471.17 1-methoxy-2-propyl acetate 417.48 2-(2-methoxypropoxy) propanol 382.34 mesitylene 158.36 ε-caprolactone 743.5 p-cymene 145.43 epichlorohydrin 994.1 1,1,1-trichloroethane 857.17 2-aminoethanol 190.55 morpholine-4-carbaldehyde 657.47 sulfolane 1000.23 2,2,4-trimethylpentane 46.9 2-methyltetrahydrofuran 812.74 n-hexyl acetate 506.77 isooctane 42.91 2-(2-butoxyethoxy)ethanol 508.75 sec-butyl acetate 287.04 tert-butyl acetate 382.75 decalin 92.76 glycerin 180.73 diglyme 830.78 acrylic acid 353.68 isopropyl myristate 205.93 n-butyric acid 762.06 acetyl acetate 380.65 di(2-ethylhexyl) phthalate 192.57 ethyl propionate 308.47 nitromethane 709.87 1,2-diethoxyethane 541.28 benzonitrile 547.42 trioctyl phosphate 138.07 1-bromopropane 664.23 gamma-valerolactone 925.9 n-decanol 164.42 triethyl phosphate 167.52 4-methyl-2-pentanol 253.47 propionitrile 503.94 vinylene carbonate 557.29 1,1,2-trichlorotrifluoroethane 631.78 DMS 328.44 cumene 167.63 2-octanol 163.42 2-hexanone 435.16 octyl acetate 255.03 limonene 220.75 1,2-dimethoxyethane 723.15 ethyl orthosilicate 162.91 tributyl phosphate 178.67 diacetone alcohol 401.97 N,N-dimethylaniline 264.78 acrylonitrile 549.13 aniline 392.29 1,3-propanediol 339.64 bromobenzene 700.97 dibromomethane 1130.07 1,1,2,2-tetrachloroethane 1520.36 2-methyl-cyclohexyl acetate 297.45 tetrabutyl urea 222.15 diisobutyl methanol 180.65 2-phenylethanol 353.51 styrene 332.78 dioctyl adipate 284.07 dimethyl sulfate 235.44 ethyl butyrate 376.83 methyl lactate 193.48 butyl lactate 279.57 diethyl carbonate 272.12 propanediol butyl ether 342.01 triethyl orthoformate 255.85 p-tert-butyltoluene 134.4 methyl 4-tert-butylbenzoate 319.56 morpholine 867.19 tert-butylamine 437.54 n-dodecanol 123.74 dimethoxymethane 419.73 ethylene carbonate 464.24 cyrene 272.65 2-ethoxyethyl acetate 388.33 2-ethylhexyl acetate 409.53 1,2,4-trichlorobenzene 580.8 4-methylpyridine 866.8 dibutyl ether 364.74 2,6-dimethyl-4-heptanol 180.65 DEF 542.46 dimethyl isosorbide 516.43 tetrachloroethylene 894.78 eugenol 315.92 triacetin 400.24 span 80 370.15 1,4-butanediol 153.2 1,1-dichloroethane 1050.51 2-methyl-1-pentanol 397.83 methyl formate 265.75 2-methyl-1-butanol 461.24 n-decane 50.18 butyronitrile 625.42 3,7-dimethyl-1-octanol 273.45 1-chlorooctane 203.14 1-chlorotetradecane 83.68 n-nonane 49.06 undecane 37.63 tert-butylcyclohexane 79.41 cyclooctane 54.85 cyclopentanol 516.67 tetrahydropyran 970.55 tert-amyl methyl ether 341.85 2,5,8-trioxanonane 592.48 1-hexene 410.78 2-isopropoxyethanol 304.66 2,2,2-trifluoroethanol 142.2 methyl butyrate 476.63 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
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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
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No restriction |