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Ethyl-2-phenylpropionat
ethyl 2-phenylpropanoate · NSC 254979 · ethyl hydratropate · Ethyl Hydrotropate · RARECHEM AL BI 0123 · 4-(Chloromethyl)-αETHYL 2-PHENYLPROPIONATE · Ethyl α-methylbenzeneacetate · Hydratropic acid ethyl ester
Identifikatoren & physikalische Daten
| CAS No. | 2510-99-8 |
|---|---|
| Summenformel | C11H14O2 |
| Durchschnittliche Molmasse | 178,23 g/mol |
| Monoisotopische Masse | 178,09937969 g/mol |
| SMILES | CCOC(=O)C(C)c1ccccc1 |
| InChIKey | UTUVIKZNQWNGIM-UHFFFAOYSA-N |
| PubChem CID | 99643 |
| ChEMBL | CHEMBL165835 |
| EC No. | 219-727-1 |
| DTXSID | DTXSID30862976 |
| Lokaler Name | Ethyl-2-phenylpropionat |
Chemische & physikalische Eigenschaften
| XLogP | 2,7 |
|---|---|
| Polarare Oberfläche (TPSA) | 26,3 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 2 |
| Frei drehbare Bindungen | 4 |
| Schwere Atome | 13 |
| Formalladung | 0 |
| Komplexität | 159 |
| Aromastoffe | EU Flavoring substances |
| Siedepunkt | 122°C 20mm |
| Dichte | 1.012±0.06 g/cm3(Predicted) |
| Lagerbedingungen | Sealed in dry,Room Temperature |
| Löslichkeit | Chloroform (Sparingly, Heated, Sonicated), Ethyl Acetate (Slightly) |
| Aggregatzustand | White to Pale Yellow Semi-Solid |
| LogP (Verteilungskoeffizient) | 2.774 (est) |
| EPA chemische Informationen | Benzeneacetic acid, .alpha.-methyl-, ethyl ester (2510-99-8) |
Sicherheit & Vorschriften
| GHS-Einstufung | WarningH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 (click each P-code to see the statement)The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory. |
|---|---|
| Regulatorische Informationen | Chemical: Benzeneacetic acid, .alpha.-methyl-, ethyl esterCommission Regulation (EC) No 1565/2000 (Repealed by Com. Implementing Reg. (EU) No 872/2012)Benzeneacetic acid, .alpha.-methyl-, ethyl ester: Does not have an individual approval but may be used under an appropriate group standard |
| Weitere Sicherheitsinformationen | Evaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia |
| Hazard Classes and Categories | Skin Irrit. 2 (100%) |
| TSCA-Inventar-Status | TSCA listed |
| Zollcode | 2916399090 |
| R-Sätze (R) | 36/37/38 |
| Gefahrensymbole | Xi |
| hazard_note | Irritant |
| Sicherheitshinweise (S) | 26-36/37/39 |
Anwendungen & Verwendung
Verwenden
2-Phenylpropionic Acid Ethyl Ester (cas# 2510-99-8) is a compound useful in organic synthesis.