2-(2,2-Diethoxyethoxy)naphthalene
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Identifiers
Molecular formula
C16H20O3SMILES
CCOC(COC1=CC2=CC=CC=C2C=C1)OCC
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Odor profile
Fragrance Floral 72.21% Sweet 49.69% Fruity 49.01% Rose 42.35% Balsamic 36.18% Fresh 35.88% Hyacinth 34.21% Spicy 33.58% Green 33.45% Honey 30.71% Flavor Floral 65.12% Green 55.86% Fruity 54.75% Bitter 43.6% Rose 42.02% Sweet 39.51% Earthy 37.49% Hyacinth 33.16% Musty 28.86% Honey 28.75% Odor impact est.
Low -
Properties
XLogP3-AA
4.1pKa est.
6.77 (neutral)Molecular weight
260.33 g/molVapor pressure est.
- hPa @ 20°C
- hPa @ 25°C
Evaporation rate
Ultra slowBoiling point est.
355°CFlash point
- 153.86 ˚C est.
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Synonyms
- NSC67881
- NSC-67881
- AKOS012938001
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Applications
Chemical name: 2-(2,2-Diethoxyethoxy)naphthalene. 2-(2,2-Diethoxyethoxy)naphthalene is a naphthalene-derived compound bearing a diethoxyethoxy acetal substituent, primarily encountered as an organic-synthesis intermediate and a building block for more complex aryl derivatives. In practice, it is used as a stepping stone to prepare further naphthalene-based compounds and to enable multi-step synthetic sequences. The acetal moiety can serve as a protecting group for carbonyl functionalities in synthetic routes, allowing selective transformations at other sites before deprotection. As a rigid aryl building block, it is of interest for development of polymers and functional materials, including aromatic polymers and related systems. It may also be evaluated as a specialty intermediate in dyes and materials chemistry, subject to formulation constraints and regulatory considerations.
gpt-5-nano
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Solubility @25˚C
Solvent Solubility (g/L) ethanol 185.4 methanol 209.37 isopropanol 103.64 water 0.57 ethyl acetate 694.52 n-propanol 162.15 acetone 528.97 n-butanol 150.88 acetonitrile 516.17 DMF 262.45 toluene 272.91 isobutanol 113.86 1,4-dioxane 1239.71 methyl acetate 505.64 THF 869.31 2-butanone 368.9 n-pentanol 143.27 sec-butanol 109.53 n-hexane 82.21 ethylene glycol 31.89 NMP 237.38 cyclohexane 276.22 DMSO 681.33 n-butyl acetate 368.11 n-octanol 51.11 chloroform 2493.37 n-propyl acetate 408.3 acetic acid 381.48 dichloromethane 3527.97 cyclohexanone 601.0 propylene glycol 27.84 isopropyl acetate 278.06 DMAc 343.4 2-ethoxyethanol 311.06 isopentanol 125.77 n-heptane 58.87 ethyl formate 299.18 1,2-dichloroethane 2212.02 n-hexanol 125.26 2-methoxyethanol 283.33 isobutyl acetate 218.37 tetrachloromethane 310.43 n-pentyl acetate 172.9 transcutol 654.32 n-heptanol 55.98 ethylbenzene 156.85 MIBK 160.0 2-propoxyethanol 232.36 tert-butanol 160.45 MTBE 237.3 2-butoxyethanol 124.82 propionic acid 202.36 o-xylene 145.81 formic acid 89.85 diethyl ether 643.75 m-xylene 129.91 p-xylene 203.32 chlorobenzene 490.2 dimethyl carbonate 180.77 n-octane 25.15 formamide 169.72 cyclopentanone 528.37 2-pentanone 292.26 anisole 282.84 cyclopentyl methyl ether 371.77 gamma-butyrolactone 672.52 1-methoxy-2-propanol 151.66 pyridine 797.96 3-pentanone 327.55 furfural 545.3 n-dodecane 16.13 diethylene glycol 148.78 diisopropyl ether 114.39 tert-amyl alcohol 121.9 acetylacetone 427.49 n-hexadecane 18.66 acetophenone 245.35 methyl propionate 347.78 isopentyl acetate 276.62 trichloroethylene 2373.91 n-nonanol 55.38 cyclohexanol 212.18 benzyl alcohol 171.11 2-ethylhexanol 100.41 isooctanol 52.37 dipropyl ether 277.6 1,2-dichlorobenzene 430.24 ethyl lactate 104.31 propylene carbonate 366.06 n-methylformamide 162.79 2-pentanol 90.27 n-pentane 58.22 1-propoxy-2-propanol 150.91 1-methoxy-2-propyl acetate 237.57 2-(2-methoxypropoxy) propanol 136.34 mesitylene 87.0 ε-caprolactone 520.17 p-cymene 83.67 epichlorohydrin 1212.91 1,1,1-trichloroethane 1125.05 2-aminoethanol 65.45 morpholine-4-carbaldehyde 382.11 sulfolane 575.03 2,2,4-trimethylpentane 23.56 2-methyltetrahydrofuran 560.41 n-hexyl acetate 178.42 isooctane 14.9 2-(2-butoxyethoxy)ethanol 174.61 sec-butyl acetate 233.34 tert-butyl acetate 232.72 decalin 65.56 glycerin 53.0 diglyme 500.82 acrylic acid 175.99 isopropyl myristate 88.46 n-butyric acid 295.04 acetyl acetate 489.04 di(2-ethylhexyl) phthalate 70.98 ethyl propionate 340.15 nitromethane 727.54 1,2-diethoxyethane 484.26 benzonitrile 247.81 trioctyl phosphate 47.89 1-bromopropane 868.0 gamma-valerolactone 581.3 n-decanol 43.51 triethyl phosphate 155.74 4-methyl-2-pentanol 54.69 propionitrile 315.96 vinylene carbonate 391.39 1,1,2-trichlorotrifluoroethane 421.35 DMS 245.69 cumene 98.84 2-octanol 39.92 2-hexanone 284.29 octyl acetate 102.34 limonene 117.58 1,2-dimethoxyethane 721.02 ethyl orthosilicate 145.01 tributyl phosphate 79.04 diacetone alcohol 148.63 N,N-dimethylaniline 162.17 acrylonitrile 343.21 aniline 241.07 1,3-propanediol 116.74 bromobenzene 589.25 dibromomethane 2019.47 1,1,2,2-tetrachloroethane 1865.78 2-methyl-cyclohexyl acetate 208.62 tetrabutyl urea 95.06 diisobutyl methanol 65.42 2-phenylethanol 147.44 styrene 221.98 dioctyl adipate 143.38 dimethyl sulfate 214.25 ethyl butyrate 330.79 methyl lactate 82.31 butyl lactate 96.44 diethyl carbonate 277.31 propanediol butyl ether 67.0 triethyl orthoformate 217.14 p-tert-butyltoluene 73.56 methyl 4-tert-butylbenzoate 149.01 morpholine 840.33 tert-butylamine 107.35 n-dodecanol 37.56 dimethoxymethane 366.68 ethylene carbonate 386.96 cyrene 137.8 2-ethoxyethyl acetate 272.71 2-ethylhexyl acetate 242.13 1,2,4-trichlorobenzene 446.96 4-methylpyridine 455.64 dibutyl ether 187.24 2,6-dimethyl-4-heptanol 65.42 DEF 330.28 dimethyl isosorbide 286.09 tetrachloroethylene 1312.1 eugenol 136.48 triacetin 204.97 span 80 96.65 1,4-butanediol 60.89 1,1-dichloroethane 1197.36 2-methyl-1-pentanol 132.86 methyl formate 181.32 2-methyl-1-butanol 122.07 n-decane 27.83 butyronitrile 287.03 3,7-dimethyl-1-octanol 62.14 1-chlorooctane 87.35 1-chlorotetradecane 41.12 n-nonane 27.83 undecane 19.89 tert-butylcyclohexane 45.26 cyclooctane 62.6 cyclopentanol 170.11 tetrahydropyran 981.61 tert-amyl methyl ether 173.36 2,5,8-trioxanonane 326.05 1-hexene 203.55 2-isopropoxyethanol 196.81 2,2,2-trifluoroethanol 146.41 methyl butyrate 423.36 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 |