Methyl (p-tolyloxy)acetate
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Identifiers
CAS number
38768-63-7Molecular formula
C10H12O3SMILES
CC1=CC=C(C=C1)OCC(=O)OC
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Odor profile
Fragrance Fruity 78.58% Floral 43.36% Honey 35.46% Green 34.24% Fatty 32.81% Nutty 32.73% Sweet 31.77% Animal 30.96% Caramellic 30.05% Berry 26.47% Flavor Sweet 76.86% Fruity 68.21% Floral 62.25% Balsam 53.61% Powdery 42.25% Cherry 37.18% Vanilla 35.95% Herbal 35.26% Flower 35.25% Plum 33.56% Odor impact est.
High -
Properties
XLogP3-AA
1.8pKa est.
6.83 (neutral)Molecular weight
180.2 g/molVapor pressure est.
- hPa @ 20°C
- hPa @ 25°C
Evaporation rate
SlowBoiling point est.
252°CFlash point
- 105.71 ˚C est.
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Synonyms
- Methyl (p-tolyloxy)acetate
- 38768-63-7
- Methyl 2-(p-tolyloxy)acetate
- methyl 2-(4-methylphenoxy)acetate
- Methyl p-tolyloxyacetate
- methyl(p-tolyloxy)acetate
- methyl p-methylphenoxyacetate
- SCHEMBL5111012
- methyl (para-tolyl oxy) acetate
- DTXSID90345114
- Methyl (4-methylphenoxy)acetate #
- Methyl (p-tolyloxy)acetate, >=98%
- AKOS000295649
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Applications
Methyl (p-tolyloxy)acetate (CAS 38768-63-7) is primarily used as an intermediate in fragrance and specialty chemical synthesis; it serves as a building block for aryl-oxyacetate esters and related aroma compounds, helping to tailor odor profiles. In perfumery and cosmetics, it is commonly used as a fragrance intermediate or precursor to more complex scent ingredients. In coatings and inks, it may be used as a specialized intermediate to introduce the p-tolyloxy functionality into ester-based odorant formulations. In household and cleaning products, it can be used as a fragrance component or formulation precursor. In industrial manufacturing and polymer-related applications, it provides a route to complex esters and can be evaluated as a reactive intermediate or functional monomer precursor for certain resin systems.
gpt-5-nano
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Solubility @25˚C
Solvent Solubility (g/L) ethanol 452.35 methanol 587.18 isopropanol 254.14 water 3.96 ethyl acetate 521.0 n-propanol 275.47 acetone 134.66 n-butanol 202.43 acetonitrile 295.56 DMF 203.73 toluene 72.12 isobutanol 142.33 1,4-dioxane 869.88 methyl acetate 392.25 THF 280.31 2-butanone 175.68 n-pentanol 128.71 sec-butanol 196.85 n-hexane 1.39 ethylene glycol 219.74 NMP 63.7 cyclohexane 6.51 DMSO 322.91 n-butyl acetate 75.36 n-octanol 27.2 chloroform 359.53 n-propyl acetate 107.63 acetic acid 393.28 dichloromethane 398.63 cyclohexanone 127.54 propylene glycol 243.74 isopropyl acetate 128.06 DMAc 287.61 2-ethoxyethanol 518.72 isopentanol 139.81 n-heptane 2.51 ethyl formate 201.69 1,2-dichloroethane 253.25 n-hexanol 77.11 2-methoxyethanol 1012.43 isobutyl acetate 48.36 tetrachloromethane 25.53 n-pentyl acetate 29.57 transcutol 796.19 n-heptanol 29.7 ethylbenzene 36.78 MIBK 61.84 2-propoxyethanol 234.72 tert-butanol 402.05 MTBE 148.68 2-butoxyethanol 96.95 propionic acid 229.06 o-xylene 53.42 formic acid 357.48 diethyl ether 175.23 m-xylene 41.77 p-xylene 47.89 chlorobenzene 84.99 dimethyl carbonate 97.44 n-octane 1.42 formamide 710.12 cyclopentanone 101.65 2-pentanone 105.17 anisole 153.69 cyclopentyl methyl ether 84.09 gamma-butyrolactone 205.8 1-methoxy-2-propanol 452.23 pyridine 329.9 3-pentanone 83.43 furfural 288.33 n-dodecane 1.86 diethylene glycol 306.35 diisopropyl ether 24.34 tert-amyl alcohol 257.85 acetylacetone 176.43 n-hexadecane 2.1 acetophenone 113.35 methyl propionate 246.91 isopentyl acetate 66.35 trichloroethylene 446.68 n-nonanol 26.75 cyclohexanol 128.59 benzyl alcohol 152.37 2-ethylhexanol 40.45 isooctanol 24.59 dipropyl ether 36.52 1,2-dichlorobenzene 79.15 ethyl lactate 67.75 propylene carbonate 117.27 n-methylformamide 248.67 2-pentanol 103.92 n-pentane 1.97 1-propoxy-2-propanol 116.18 1-methoxy-2-propyl acetate 121.38 2-(2-methoxypropoxy) propanol 124.28 mesitylene 22.6 ε-caprolactone 158.93 p-cymene 19.74 epichlorohydrin 402.62 1,1,1-trichloroethane 151.63 2-aminoethanol 388.43 morpholine-4-carbaldehyde 308.96 sulfolane 144.83 2,2,4-trimethylpentane 3.1 2-methyltetrahydrofuran 197.71 n-hexyl acetate 47.75 isooctane 1.99 2-(2-butoxyethoxy)ethanol 178.36 sec-butyl acetate 66.18 tert-butyl acetate 112.08 decalin 4.62 glycerin 351.55 diglyme 365.51 acrylic acid 193.49 isopropyl myristate 21.59 n-butyric acid 276.93 acetyl acetate 196.07 di(2-ethylhexyl) phthalate 28.84 ethyl propionate 114.38 nitromethane 650.52 1,2-diethoxyethane 158.67 benzonitrile 101.38 trioctyl phosphate 15.88 1-bromopropane 74.67 gamma-valerolactone 280.87 n-decanol 21.17 triethyl phosphate 41.88 4-methyl-2-pentanol 47.88 propionitrile 177.97 vinylene carbonate 136.92 1,1,2-trichlorotrifluoroethane 298.85 DMS 83.26 cumene 23.94 2-octanol 16.94 2-hexanone 62.9 octyl acetate 26.59 limonene 25.29 1,2-dimethoxyethane 491.71 ethyl orthosilicate 41.62 tributyl phosphate 23.05 diacetone alcohol 167.93 N,N-dimethylaniline 77.38 acrylonitrile 238.21 aniline 165.18 1,3-propanediol 496.32 bromobenzene 74.47 dibromomethane 193.36 1,1,2,2-tetrachloroethane 348.75 2-methyl-cyclohexyl acetate 54.48 tetrabutyl urea 30.99 diisobutyl methanol 24.45 2-phenylethanol 99.08 styrene 49.98 dioctyl adipate 43.52 dimethyl sulfate 114.43 ethyl butyrate 73.16 methyl lactate 132.53 butyl lactate 35.82 diethyl carbonate 66.41 propanediol butyl ether 90.49 triethyl orthoformate 54.73 p-tert-butyltoluene 19.56 methyl 4-tert-butylbenzoate 67.84 morpholine 864.61 tert-butylamine 149.81 n-dodecanol 17.42 dimethoxymethane 287.47 ethylene carbonate 117.67 cyrene 98.76 2-ethoxyethyl acetate 86.73 2-ethylhexyl acetate 47.87 1,2,4-trichlorobenzene 101.6 4-methylpyridine 209.67 dibutyl ether 33.28 2,6-dimethyl-4-heptanol 24.45 DEF 157.66 dimethyl isosorbide 168.62 tetrachloroethylene 198.02 eugenol 82.23 triacetin 79.11 span 80 73.76 1,4-butanediol 155.18 1,1-dichloroethane 183.25 2-methyl-1-pentanol 100.3 methyl formate 188.97 2-methyl-1-butanol 126.29 n-decane 2.63 butyronitrile 130.57 3,7-dimethyl-1-octanol 34.78 1-chlorooctane 13.78 1-chlorotetradecane 6.8 n-nonane 2.11 undecane 2.15 tert-butylcyclohexane 4.38 cyclooctane 2.15 cyclopentanol 98.52 tetrahydropyran 286.87 tert-amyl methyl ether 101.29 2,5,8-trioxanonane 279.46 1-hexene 11.8 2-isopropoxyethanol 234.05 2,2,2-trifluoroethanol 148.34 methyl butyrate 138.6 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 |