[3-(dibenzylamino)cyclohexyl] N-methylcarbamate
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Identifiers
Molecular formula
C22H28N2O2SMILES
CNC(=O)OC1CCCC(C1)N(CC2=CC=CC=C2)CC3=CC=CC=C3
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Odor profile
Fragrance Sweet 34.18% Fruity 32.22% Floral 28.99% Animal 26.33% Grape 25.85% Odorless 25.76% Citrus 25.04% Cooling 24.15% Balsamic 23.35% Bitter 22.82% Flavor Fruity 42.39% Bitter 35.11% Waxy 28.72% Mild 28.59% Sweet 27.87% Floral 27.04% Odorless 24.09% Green 21.93% Pastry 19.92% Honeysuckle 19.81% Odor impact est.
Low -
Properties
XLogP3-AA
4.3pKa est.
7.73 (neutral)Molecular weight
352.5 g/molVapor pressure est.
- hPa @ 20°C
- hPa @ 25°C
Evaporation rate
Ultra slowBoiling point est.
487°CFlash point
- 215.37 ˚C est.
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Synonyms
- NSC128134
- NSC-128134
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Applications
[3-(dibenzylamino)cyclohexyl] N-methylcarbamate applications include its use as an intermediate in agrochemical synthesis, particularly for carbamate-based insecticides; as a building block or protected-amine scaffold in pharmaceutical research and development; as a precursor for polymer or coating formulations that incorporate carbamate functionality; and as a reference or building block in organic synthesis for carbamate chemistry studies. Use is generally subject to local regulations and formulation constraints.
gpt-5-nano
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Solubility @25˚C
Solvent Solubility (g/L) ethanol 37.27 methanol 50.03 isopropanol 18.85 water 0.25 ethyl acetate 50.22 n-propanol 37.43 acetone 75.08 n-butanol 35.91 acetonitrile 21.2 DMF 103.5 toluene 40.04 isobutanol 28.37 1,4-dioxane 73.07 methyl acetate 47.63 THF 140.87 2-butanone 85.5 n-pentanol 36.84 sec-butanol 29.13 n-hexane 1.25 ethylene glycol 5.39 NMP 86.97 cyclohexane 1.9 DMSO 125.91 n-butyl acetate 42.35 n-octanol 10.74 chloroform 366.66 n-propyl acetate 43.7 acetic acid 82.42 dichloromethane 325.66 cyclohexanone 116.05 propylene glycol 15.41 isopropyl acetate 35.98 DMAc 244.86 2-ethoxyethanol 73.9 isopentanol 33.68 n-heptane 1.01 ethyl formate 45.99 1,2-dichloroethane 171.46 n-hexanol 24.36 2-methoxyethanol 71.21 isobutyl acetate 31.54 tetrachloromethane 18.33 n-pentyl acetate 30.65 transcutol 179.41 n-heptanol 17.7 ethylbenzene 16.66 MIBK 39.86 2-propoxyethanol 64.09 tert-butanol 19.33 MTBE 20.84 2-butoxyethanol 50.24 propionic acid 46.81 o-xylene 22.05 formic acid 38.49 diethyl ether 28.58 m-xylene 21.49 p-xylene 21.35 chlorobenzene 66.33 dimethyl carbonate 32.91 n-octane 0.69 formamide 60.34 cyclopentanone 125.0 2-pentanone 63.96 anisole 35.13 cyclopentyl methyl ether 46.98 gamma-butyrolactone 127.9 1-methoxy-2-propanol 58.1 pyridine 92.86 3-pentanone 55.59 furfural 129.9 n-dodecane 0.62 diethylene glycol 43.78 diisopropyl ether 7.51 tert-amyl alcohol 25.41 acetylacetone 71.15 n-hexadecane 0.72 acetophenone 49.54 methyl propionate 49.38 isopentyl acetate 39.91 trichloroethylene 336.36 n-nonanol 12.23 cyclohexanol 32.84 benzyl alcohol 45.9 2-ethylhexanol 17.0 isooctanol 16.09 dipropyl ether 16.25 1,2-dichlorobenzene 60.77 ethyl lactate 34.15 propylene carbonate 81.85 n-methylformamide 49.71 2-pentanol 20.69 n-pentane 0.95 1-propoxy-2-propanol 43.48 1-methoxy-2-propyl acetate 54.82 2-(2-methoxypropoxy) propanol 42.97 mesitylene 11.17 ε-caprolactone 91.64 p-cymene 10.64 epichlorohydrin 192.72 1,1,1-trichloroethane 78.86 2-aminoethanol 20.5 morpholine-4-carbaldehyde 95.39 sulfolane 145.72 2,2,4-trimethylpentane 1.65 2-methyltetrahydrofuran 62.58 n-hexyl acetate 30.79 isooctane 0.89 2-(2-butoxyethoxy)ethanol 57.92 sec-butyl acetate 30.23 tert-butyl acetate 33.8 decalin 2.18 glycerin 26.19 diglyme 112.79 acrylic acid 47.81 isopropyl myristate 12.1 n-butyric acid 68.35 acetyl acetate 37.96 di(2-ethylhexyl) phthalate 21.6 ethyl propionate 34.24 nitromethane 104.4 1,2-diethoxyethane 46.47 benzonitrile 41.78 trioctyl phosphate 12.64 1-bromopropane 59.81 gamma-valerolactone 161.96 n-decanol 9.05 triethyl phosphate 24.03 4-methyl-2-pentanol 16.02 propionitrile 27.85 vinylene carbonate 81.37 1,1,2-trichlorotrifluoroethane 155.99 DMS 36.48 cumene 11.77 2-octanol 9.59 2-hexanone 48.49 octyl acetate 16.44 limonene 13.13 1,2-dimethoxyethane 84.91 ethyl orthosilicate 23.16 tributyl phosphate 16.38 diacetone alcohol 44.08 N,N-dimethylaniline 25.92 acrylonitrile 35.4 aniline 51.74 1,3-propanediol 31.89 bromobenzene 63.76 dibromomethane 180.96 1,1,2,2-tetrachloroethane 279.98 2-methyl-cyclohexyl acetate 32.12 tetrabutyl urea 21.43 diisobutyl methanol 9.9 2-phenylethanol 37.74 styrene 21.0 dioctyl adipate 23.81 dimethyl sulfate 57.97 ethyl butyrate 34.0 methyl lactate 39.01 butyl lactate 35.49 diethyl carbonate 26.34 propanediol butyl ether 36.77 triethyl orthoformate 30.31 p-tert-butyltoluene 9.08 methyl 4-tert-butylbenzoate 43.42 morpholine 86.95 tert-butylamine 10.09 n-dodecanol 6.55 dimethoxymethane 76.71 ethylene carbonate 66.02 cyrene 56.45 2-ethoxyethyl acetate 52.81 2-ethylhexyl acetate 32.37 1,2,4-trichlorobenzene 73.52 4-methylpyridine 78.39 dibutyl ether 13.18 2,6-dimethyl-4-heptanol 9.9 DEF 67.6 dimethyl isosorbide 72.04 tetrachloroethylene 153.32 eugenol 45.23 triacetin 45.33 span 80 36.78 1,4-butanediol 20.06 1,1-dichloroethane 113.4 2-methyl-1-pentanol 36.46 methyl formate 44.63 2-methyl-1-butanol 34.98 n-decane 1.12 butyronitrile 34.02 3,7-dimethyl-1-octanol 12.76 1-chlorooctane 6.83 1-chlorotetradecane 2.71 n-nonane 0.9 undecane 0.79 tert-butylcyclohexane 1.73 cyclooctane 0.74 cyclopentanol 30.71 tetrahydropyran 67.19 tert-amyl methyl ether 23.8 2,5,8-trioxanonane 73.09 1-hexene 9.5 2-isopropoxyethanol 51.73 2,2,2-trifluoroethanol 40.16 methyl butyrate 49.71 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 |