(2-Formyloxy-2-phenylethyl) formate
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Identifiers
Molecular formula
C10H10O4SMILES
C1=CC=C(C=C1)C(COC=O)OC=O
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Odor profile
Fragrance Balsamic 38.2% Green 36.93% Fruity 33.08% Floral 31.69% Odorless 29.78% Sweet 29.55% Herbal 27.37% Honey 24.5% Fresh 23.55% Nutty 22.61% Flavor Floral 56.69% Fruity 56.31% Green 44.74% Bitter 40.15% Sweet 38.14% Rose 33.57% Balsam 31.19% Musty 27.1% Oily 25.92% Hyacinth 25.74% Odor impact est.
Medium -
Properties
XLogP3-AA
1.6pKa est.
5.79 (weak acid)Molecular weight
194.18 g/molVapor pressure est.
- hPa @ 20°C
- hPa @ 25°C
Evaporation rate
Ultra slowBoiling point est.
279°CFlash point
- 139.74 ˚C est.
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Synonyms
- NSC50317
- NSC-50317
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Applications
(2-Formyloxy-2-phenylethyl) formate is commonly used as a fragrance ingredient and fixative in perfumery and cosmetics; it may be employed as a fragrance additive in household products to impart lasting aroma; it can function as a solvent or processing diluent in coatings and inks; and it serves as an organic intermediate in industrial manufacturing, including polymer and plastics synthesis.
gpt-5-nano
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Solubility @25˚C
Solvent Solubility (g/L) ethanol 44.65 methanol 104.79 isopropanol 17.73 water 1.3 ethyl acetate 102.81 n-propanol 25.44 acetone 161.38 n-butanol 17.05 acetonitrile 119.76 DMF 372.52 toluene 25.26 isobutanol 14.46 1,4-dioxane 112.73 methyl acetate 133.48 THF 141.82 2-butanone 105.86 n-pentanol 16.44 sec-butanol 16.68 n-hexane 0.65 ethylene glycol 49.83 NMP 289.23 cyclohexane 2.23 DMSO 859.52 n-butyl acetate 45.83 n-octanol 9.4 chloroform 113.59 n-propyl acetate 61.42 acetic acid 144.25 dichloromethane 226.81 cyclohexanone 119.34 propylene glycol 21.63 isopropyl acetate 43.73 DMAc 359.55 2-ethoxyethanol 100.0 isopentanol 18.61 n-heptane 1.56 ethyl formate 60.82 1,2-dichloroethane 219.82 n-hexanol 18.1 2-methoxyethanol 155.59 isobutyl acetate 25.17 tetrachloromethane 10.15 n-pentyl acetate 19.34 transcutol 343.3 n-heptanol 9.6 ethylbenzene 17.91 MIBK 39.12 2-propoxyethanol 60.47 tert-butanol 39.95 MTBE 26.73 2-butoxyethanol 34.61 propionic acid 69.49 o-xylene 27.48 formic acid 149.72 diethyl ether 33.26 m-xylene 20.25 p-xylene 21.29 chlorobenzene 49.49 dimethyl carbonate 77.8 n-octane 0.74 formamide 401.57 cyclopentanone 191.42 2-pentanone 64.1 anisole 62.91 cyclopentyl methyl ether 55.68 gamma-butyrolactone 271.11 1-methoxy-2-propanol 76.27 pyridine 148.6 3-pentanone 62.49 furfural 225.23 n-dodecane 0.81 diethylene glycol 86.81 diisopropyl ether 8.77 tert-amyl alcohol 32.99 acetylacetone 128.33 n-hexadecane 0.94 acetophenone 79.03 methyl propionate 107.77 isopentyl acetate 38.36 trichloroethylene 334.27 n-nonanol 9.46 cyclohexanol 22.9 benzyl alcohol 52.27 2-ethylhexanol 14.45 isooctanol 9.27 dipropyl ether 19.35 1,2-dichlorobenzene 55.58 ethyl lactate 39.51 propylene carbonate 113.96 n-methylformamide 216.57 2-pentanol 11.48 n-pentane 0.66 1-propoxy-2-propanol 38.05 1-methoxy-2-propyl acetate 61.24 2-(2-methoxypropoxy) propanol 59.31 mesitylene 12.97 ε-caprolactone 95.86 p-cymene 13.45 epichlorohydrin 296.53 1,1,1-trichloroethane 68.38 2-aminoethanol 50.57 morpholine-4-carbaldehyde 210.7 sulfolane 385.62 2,2,4-trimethylpentane 1.13 2-methyltetrahydrofuran 82.84 n-hexyl acetate 27.03 isooctane 0.78 2-(2-butoxyethoxy)ethanol 67.06 sec-butyl acetate 34.59 tert-butyl acetate 49.25 decalin 2.59 glycerin 62.26 diglyme 172.72 acrylic acid 98.41 isopropyl myristate 12.87 n-butyric acid 55.02 acetyl acetate 73.2 di(2-ethylhexyl) phthalate 17.98 ethyl propionate 58.75 nitromethane 497.16 1,2-diethoxyethane 54.29 benzonitrile 60.1 trioctyl phosphate 11.11 1-bromopropane 38.97 gamma-valerolactone 192.71 n-decanol 7.59 triethyl phosphate 31.25 4-methyl-2-pentanol 9.79 propionitrile 59.65 vinylene carbonate 105.6 1,1,2-trichlorotrifluoroethane 203.01 DMS 65.25 cumene 12.68 2-octanol 5.65 2-hexanone 45.05 octyl acetate 16.24 limonene 18.08 1,2-dimethoxyethane 146.57 ethyl orthosilicate 24.85 tributyl phosphate 16.09 diacetone alcohol 74.77 N,N-dimethylaniline 45.24 acrylonitrile 127.68 aniline 51.35 1,3-propanediol 51.94 bromobenzene 44.94 dibromomethane 105.13 1,1,2,2-tetrachloroethane 216.32 2-methyl-cyclohexyl acetate 35.59 tetrabutyl urea 25.5 diisobutyl methanol 10.59 2-phenylethanol 38.09 styrene 25.43 dioctyl adipate 26.89 dimethyl sulfate 166.6 ethyl butyrate 44.79 methyl lactate 62.97 butyl lactate 24.37 diethyl carbonate 39.98 propanediol butyl ether 34.67 triethyl orthoformate 31.26 p-tert-butyltoluene 11.9 methyl 4-tert-butylbenzoate 50.54 morpholine 131.77 tert-butylamine 15.88 n-dodecanol 6.2 dimethoxymethane 139.17 ethylene carbonate 77.28 cyrene 75.14 2-ethoxyethyl acetate 46.12 2-ethylhexyl acetate 29.32 1,2,4-trichlorobenzene 74.73 4-methylpyridine 92.2 dibutyl ether 14.16 2,6-dimethyl-4-heptanol 10.59 DEF 119.39 dimethyl isosorbide 108.14 tetrachloroethylene 135.04 eugenol 50.45 triacetin 60.8 span 80 35.22 1,4-butanediol 24.91 1,1-dichloroethane 81.77 2-methyl-1-pentanol 19.47 methyl formate 159.69 2-methyl-1-butanol 16.91 n-decane 1.2 butyronitrile 35.43 3,7-dimethyl-1-octanol 12.39 1-chlorooctane 6.71 1-chlorotetradecane 3.26 n-nonane 0.99 undecane 0.96 tert-butylcyclohexane 1.86 cyclooctane 1.03 cyclopentanol 29.29 tetrahydropyran 59.99 tert-amyl methyl ether 27.22 2,5,8-trioxanonane 118.17 1-hexene 4.58 2-isopropoxyethanol 56.82 2,2,2-trifluoroethanol 97.94 methyl butyrate 75.26 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 |