HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 21962087Erstellt: 27. Oktober 2026
tert-Butyl 3-oxo-1,4-diazepane-1-carboxylate
1-Boc-3-oxohoMopiperazine · 1-Boc-3-Oxo-1,4-diazepane · tert-butyl 3-oxo-1,4-diazepane-1-carboxylate · 3-Oxo-[1,4]diazepane-1-carboxylic acid tert-butyl ester · tert-Butyl Hexahydro-3-oxo-1H-1,4-diazepine-1-carboxylate · 1H-1,4-Diazepine-1-carboxylic acid, hexahydro-3-oxo-, 1,1-dimethylethyl ester
https://huagongshe.com/de/chemical/21962087
Identifikatoren & physikalische Daten
| CAS No. | 179686-38-5 |
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| Summenformel | C10H18N2O3 |
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| Durchschnittliche Molmasse | 214,26 g/mol |
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| Monoisotopische Masse | 214,13174244 g/mol |
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| SMILES | CC(C)(C)OC(=O)N1CCCNC(=O)C1 |
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| InChIKey | ITRUBUQWGNAYGG-UHFFFAOYSA-N |
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| PubChem CID | 21962087 |
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| EC No. | 841-389-4 |
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| DTXSID | DTXSID10620859 |
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Chemische & physikalische Eigenschaften
| XLogP | 0,6 |
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| Polarare Oberfläche (TPSA) | 58,6 |
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| H-Brücken-Donoren | 1 |
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| H-Brücken-Akzeptoren | 3 |
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| Frei drehbare Bindungen | 2 |
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| Schwere Atome | 15 |
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| Formalladung | 0 |
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| Komplexität | 258 |
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| Siedepunkt | 373.1±35.0 °C(Predicted) |
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| Dichte | 1.098 |
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| Lagerbedingungen | Sealed in dry,Room Temperature |
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| pKa (Säurekonstante) | 15.56±0.20(Predicted) |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposureRespiratory tract irritation]P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory. |
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| Hazard Classes and Categories | Skin Irrit. 2 (100%)Eye Irrit. 2A (100%)STOT SE 3 (100%) |
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| Alarmwort | Warnung |
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| Gefahrenhinweise | Code Gefahrenhinweise Gefahrenklasse Abteilung Alarmwort Symbol P-Code H315 |
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