| |
| Right Click Picture For More Options. (Safari 1.2 (v125) Compatible). |
| |
|
|
| IUPAC name : | 1-(4-ethylphenyl)ethanone |
| InChI : | InChI=1/C10H12O/c1-3-9-4-6-10(7-5-9)8(2)11/h4-7H,3H2,1-2H3 |
| InChIKey : | NODGRWCMFMEGJH-UHFFFAOYAX |
| SMILES : | CCC1=CC=C(C=C1)C(=O)C |
| cas number : | 937-30-4 |
| (EINECS) number : | 213-326-5 |
| molar refractivity : | 45.83 ± 0.3 cm3 |
| parachor : | 369.0 ± 4.0 cm3 |
| index of refraction : | 1.507 ± 0.02 |
| surface tension : | 33.1 ± 3.0 dyne/cm |
| density : | 0.963 ± 0.06 g/cm3 |
| polarizability : | 18.16 ± 0.5 10-24cm3 |
| XlogP : | 2.80 |
| molecular weight : | 148.2016800 |
| formula : | C10 H12 O |
| BioActivity Analysis : | 72728 |
| NMR Predictor : | Predict |
|
|
| |
| |
| export tariff code : | unspecified |
| fda reg : | unspecified |
Suppliers :
|
| Sigma-Aldrich-Aldrich : | p-Ethyl acetophenone
|
organoleptics :
|
| odor type : | floral |
| odor strength : | high , recommend smelling in a 1.00 % solution or less |
odor description : at 1.00 % in dipropylene glycol. | floral hawthorn |
properties :
|
| appearence : | colorless clear liquid |
| assay : | 97.00 to 100.00 %
|
| Food Chemicals Codex Listed : | No |
| specific gravity : | 0.99300 @ 25.00 °C.
|
| refractive index : | 1.52930 @ 20.00 °C.
|
| melting point : | -20.60 °C. @ 760.00 mm Hg
|
| boiling point : | 125.00 °C. @ 20.00 mm Hg
|
| boiling point : | 239.00 to 240.00 °C. @ 760.00 mm Hg
|
| vapor pressure : | 0.91400 mm/Hg @ 25.00 °C. |
| flash point : | 195.00 °F. TCC ( 90.56 °C. )
|
| logP (o/w) : | 2.71 |
safety :
|
| most important hazard(s) : | Xi - Irritant |
| |
R 36/38 - Irritating to skin and eyes. S 02 - Keep out of the reach of children. S 24/25 - Avoid contact with skin and eyes. S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S 36 - Wear suitable protective clothing.
|
| Oral Toxicity(LD50) : |
| |
Not determined
|
| Dermal Toxicity(LD50) : |
| |
Not determined
|
| Inhalation Toxicity(LC50) : |
| |
Not determined
|
| |
safety in use :
|
| |
| recommendation for para-ethyl acetophenone usage levels up to : |
| | 3.0000 % in the fragrance concentrate.
|
safety references :
|
| EPI System : | view |
| Env. Mutagen Info. Center : | Search |
| Canada Domestic Sub. List : | Yes |
| EPA Chem. Sub. Inventory : | Yes |
| |
| WGK Germany : | 3 |
| |
| |
| |
| | 1-(4-ethylphenyl)ethanone
|
| (EINECS) number : | 213-326-5 |
| chemidplus : | 000937304 |
| EPA Substance Registry Services : | 937-30-4 |
| dtp/nci : | 6768 |
references :
|
| | 1-(4-ethylphenyl)ethanone
|
| NIST Chemistry WebBook : | 389279868 |
| pubchem : | 156982 |
Cosmetics :
|
| Cosmetic uses : |
perfuming agents
|
other :
|
| CosIng : | cosmetic data |