1,3-Dioxacyclohexadecan-2-one
-
Identifiers
Molecular formula
C14H26O3SMILES
C1CCCCCCOC(=O)OCCCCCC1
-
Odor profile
Fragrance Musk 77.87% Sweet 72.89% Animal 55.58% Fruity 53.59% Amber 49.36% Waxy 48.34% Woody 47.63% Powdery 47.22% Floral 36.32% Dry 34.84% Flavor Fruity 63.86% Animal 34.36% Natural 28.05% Powdery 26.42% Fruit 25.23% Musk 24.67% Cheese 22.16% Sweet 21.53% Shrimp 21.06% Musky 20.99% Odor impact est.
High -
Properties
XLogP3-AA
5.5pKa est.
11.67 (strong base)Molecular weight
242.35 g/molVapor pressure est.
- hPa @ 20°C
- hPa @ 25°C
Evaporation rate
Ultra slowBoiling point est.
381°CFlash point
- 155.61 ˚C est.
-
Synonyms
- SCHEMBL11257558
-
Applications
1,3-Dioxacyclohexadecan-2-one can be used as a monomer for polymer synthesis (polycarbonate or polyester) and as a solvent or processing aid in industrial manufacturing; it serves as a reactive diluent or crosslinking-compatible component in coatings, paints, and adhesives; it is evaluated as a reactive solvent and cleaning solvent in processing and manufacturing; and it may be explored for electronics and energy storage applications, such as an electrolyte solvent or component in electronic systems.
gpt-5-nano
-
Solubility @25˚C
Solvent Solubility (g/L) ethanol 465.92 methanol 391.62 isopropanol 500.84 water 0.05 ethyl acetate 1233.72 n-propanol 476.07 acetone 1531.36 n-butanol 467.32 acetonitrile 767.83 DMF 2355.43 toluene 947.54 isobutanol 425.71 1,4-dioxane 1286.55 methyl acetate 890.59 THF 2890.75 2-butanone 1227.4 n-pentanol 349.65 sec-butanol 480.93 n-hexane 229.35 ethylene glycol 50.2 NMP 2650.96 cyclohexane 510.43 DMSO 2136.83 n-butyl acetate 1085.05 n-octanol 266.4 chloroform 4325.25 n-propyl acetate 1001.56 acetic acid 740.92 dichloromethane 4286.87 cyclohexanone 2700.44 propylene glycol 129.03 isopropyl acetate 951.41 DMAc 1743.66 2-ethoxyethanol 498.14 isopentanol 498.25 n-heptane 127.81 ethyl formate 681.14 1,2-dichloroethane 2922.36 n-hexanol 348.47 2-methoxyethanol 762.38 isobutyl acetate 633.48 tetrachloromethane 625.88 n-pentyl acetate 976.83 transcutol 2103.38 n-heptanol 232.03 ethylbenzene 447.33 MIBK 841.67 2-propoxyethanol 614.72 tert-butanol 647.14 MTBE 852.61 2-butoxyethanol 523.36 propionic acid 665.93 o-xylene 525.64 formic acid 149.24 diethyl ether 930.53 m-xylene 585.9 p-xylene 616.92 chlorobenzene 1471.34 dimethyl carbonate 457.72 n-octane 59.43 formamide 393.03 cyclopentanone 3074.87 2-pentanone 1289.71 anisole 751.49 cyclopentyl methyl ether 1560.78 gamma-butyrolactone 3121.5 1-methoxy-2-propanol 731.65 pyridine 2265.18 3-pentanone 1029.9 furfural 2223.95 n-dodecane 39.88 diethylene glycol 306.88 diisopropyl ether 400.58 tert-amyl alcohol 588.86 acetylacetone 1528.52 n-hexadecane 48.44 acetophenone 823.23 methyl propionate 964.9 isopentyl acetate 927.48 trichloroethylene 4975.72 n-nonanol 249.27 cyclohexanol 845.2 benzyl alcohol 510.46 2-ethylhexanol 299.62 isooctanol 226.72 dipropyl ether 619.65 1,2-dichlorobenzene 1403.59 ethyl lactate 347.91 propylene carbonate 1651.23 n-methylformamide 909.88 2-pentanol 448.67 n-pentane 171.48 1-propoxy-2-propanol 584.75 1-methoxy-2-propyl acetate 855.55 2-(2-methoxypropoxy) propanol 473.42 mesitylene 395.98 ε-caprolactone 2024.61 p-cymene 273.76 epichlorohydrin 2836.11 1,1,1-trichloroethane 2554.91 2-aminoethanol 192.17 morpholine-4-carbaldehyde 1852.16 sulfolane 3939.52 2,2,4-trimethylpentane 87.12 2-methyltetrahydrofuran 2016.35 n-hexyl acetate 1031.22 isooctane 72.73 2-(2-butoxyethoxy)ethanol 712.84 sec-butyl acetate 706.29 tert-butyl acetate 1037.4 decalin 194.4 glycerin 190.02 diglyme 1450.58 acrylic acid 606.71 isopropyl myristate 353.37 n-butyric acid 1149.17 acetyl acetate 875.58 di(2-ethylhexyl) phthalate 288.82 ethyl propionate 848.34 nitromethane 1645.27 1,2-diethoxyethane 968.87 benzonitrile 995.85 trioctyl phosphate 207.89 1-bromopropane 1565.48 gamma-valerolactone 2919.91 n-decanol 171.21 triethyl phosphate 357.58 4-methyl-2-pentanol 290.0 propionitrile 806.07 vinylene carbonate 1403.54 1,1,2-trichlorotrifluoroethane 1660.57 DMS 778.71 cumene 282.15 2-octanol 222.16 2-hexanone 865.98 octyl acetate 436.35 limonene 426.21 1,2-dimethoxyethane 1218.46 ethyl orthosilicate 322.95 tributyl phosphate 299.52 diacetone alcohol 814.77 N,N-dimethylaniline 506.5 acrylonitrile 1099.87 aniline 848.99 1,3-propanediol 330.76 bromobenzene 1860.51 dibromomethane 2866.91 1,1,2,2-tetrachloroethane 4282.53 2-methyl-cyclohexyl acetate 597.14 tetrabutyl urea 399.68 diisobutyl methanol 235.44 2-phenylethanol 425.02 styrene 633.54 dioctyl adipate 537.19 dimethyl sulfate 872.32 ethyl butyrate 793.34 methyl lactate 419.85 butyl lactate 563.59 diethyl carbonate 509.61 propanediol butyl ether 467.68 triethyl orthoformate 525.68 p-tert-butyltoluene 265.26 methyl 4-tert-butylbenzoate 688.38 morpholine 1686.81 tert-butylamine 480.91 n-dodecanol 130.04 dimethoxymethane 1048.62 ethylene carbonate 1173.55 cyrene 492.97 2-ethoxyethyl acetate 1036.99 2-ethylhexyl acetate 781.46 1,2,4-trichlorobenzene 1556.3 4-methylpyridine 2023.4 dibutyl ether 626.19 2,6-dimethyl-4-heptanol 235.44 DEF 1578.11 dimethyl isosorbide 981.19 tetrachloroethylene 2561.68 eugenol 519.85 triacetin 889.96 span 80 533.66 1,4-butanediol 136.89 1,1-dichloroethane 2642.16 2-methyl-1-pentanol 352.85 methyl formate 591.77 2-methyl-1-butanol 436.3 n-decane 73.79 butyronitrile 908.28 3,7-dimethyl-1-octanol 288.51 1-chlorooctane 346.65 1-chlorotetradecane 125.14 n-nonane 75.69 undecane 51.11 tert-butylcyclohexane 141.81 cyclooctane 162.21 cyclopentanol 977.09 tetrahydropyran 1889.6 tert-amyl methyl ether 693.69 2,5,8-trioxanonane 860.82 1-hexene 572.21 2-isopropoxyethanol 421.31 2,2,2-trifluoroethanol 297.7 methyl butyrate 1172.61 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 |