Identifikatoren & physikalische Daten
| CAS No. | 1331-11-9 |
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| Summenformel | C5H10O3 |
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| Durchschnittliche Molmasse | 118,13 g/mol |
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| Monoisotopische Masse | 118,06299418 g/mol |
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| SMILES | CCOCCC(=O)O |
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| InChIKey | JRXXEXVXTFEBIY-UHFFFAOYSA-N |
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| PubChem CID | 61351 |
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| EC No. | 224-357-9 |
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| DTXSID | DTXSID70863366 |
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Chemische & physikalische Eigenschaften
| XLogP | -0,1 |
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| Polarare Oberfläche (TPSA) | 46,5 |
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| H-Brücken-Donoren | 1 |
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| H-Brücken-Akzeptoren | 3 |
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| Frei drehbare Bindungen | 4 |
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| Schwere Atome | 8 |
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| Formalladung | 0 |
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| Komplexität | 70,1 |
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| Schmelzpunkt | -10.7°C |
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| Siedepunkt | 160.67°C (rough estimate) |
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| Dichte | 1.0889 (rough estimate) |
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| Brechungsindex | 1.4056 (estimate) |
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Sicherheit & Vorschriften
| GHS-Einstufung | DangerH318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]P264+P265, P280, P305+P354+P338, and P317 (click each P-code to see the statement)Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
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| Regulatorische Informationen | Propanoic acid, 3-ethoxy-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right. |
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| Hazard Classes and Categories | Eye Dam. 1 (100%)Skin Irrit. 2 (100%) |
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| Alarmwort | Achtung |
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| Gefahrenhinweise | Code Gefahrenhinweise Gefahrenklasse Abteilung Alarmwort Symbol P-Code H318 |
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