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HCID 5826041Erstellt: 30. Oktober 2026
4-(4-(Benzyloxy)-2-methylbenzoyl)-1-(2-(diethylamino)ethyl)-3-hydroxy-5-(2-thienyl)-1,5-dihydro-2H-pyrrol-2-one
SALOR-INT L436380-1EA · 4-(4-(benzyloxy)-2-methylbenzoyl)-1-(2-(diethylamino)ethyl)-3-hydroxy-5-(thiophen-2-yl)-1H-pyrrol-2(5H)-one · 4-[4-(BENZYLOXY)-2-METHYLBENZOYL]-1-[2-(DIETHYLAMINO)ETHYL]-3-HYDROXY-5-(2-THIENYL)-1,5-DIHYDRO-2H-PYRROL-2-ONE · 2H-Pyrrol-2-one, 1-[2-(diethylamino)ethyl]-1,5-dihydro-3-hydroxy-4-[2-methyl-4-(phenylmethoxy)benzoyl]-5-(2-thienyl)-
https://huagongshe.com/de/chemical/5826041
Identifikatoren & physikalische Daten
| CAS No. | 488708-02-7 |
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| Summenformel | C29H32N2O4S |
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| Durchschnittliche Molmasse | 504,6 g/mol |
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| Monoisotopische Masse | 504,20827868 g/mol |
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| SMILES | CCN(CC)CCN1C(=O)C(=O)/C(=C(/O)c2ccc(OCc3ccccc3)cc2C)C1c1cccs1 |
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| InChIKey | QGHIXJLMQFQVRN-IMVLJIQESA-N |
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| PubChem CID | 5826041 |
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| EC No. | 646-233-7 |
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Chemische & physikalische Eigenschaften
| XLogP | 5,3 |
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| Polarare Oberfläche (TPSA) | 98,3 |
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| H-Brücken-Donoren | 1 |
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| H-Brücken-Akzeptoren | 6 |
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| Frei drehbare Bindungen | 10 |
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| Schwere Atome | 36 |
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| Formalladung | 0 |
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| Komplexität | 792 |
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| Siedepunkt | 699.8±55.0 °C(Predicted) |
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| Dichte | 1.245±0.06 g/cm3(Predicted) |
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| pKa (Säurekonstante) | 4.50±1.00(Predicted) |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P264, P270, P273, P301+P317, P330, and P501 (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. Each notification may be associated with multiple companies. |
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| Hazard Classes and Categories | Acute Tox. 4 (100%) |
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| Alarmwort | Warnung |
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| Gefahrenhinweise | Code Gefahrenhinweise Gefahrenklasse Abteilung Alarmwort Symbol P-Code H302 |
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