HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 17856495Erstellt: 29. Oktober 2026
N-t-BOC-trans-4-Fluoro-L-Prolinonitrile
Prusogliptin Impurity 21 · Boc-trans-4-fluoro-L-prolinonitrile · N-Boc-trans-4-fluoro-L-prolinonitrile · N-T-BOC-TRANS-4-FLUORO-L-PROLINONITRILE · (2S,4R)-N-Boc-4-fluoropyrrolidine-2-carbonitrile · (2S,4R)-tert-Butyl 2-cyano-4-fluoropyrrolidine-1-carboxylate · tert-butyl (2S,4R)-2-cyano-4-fluoropyrrolidine-1-carboxylate · (2S,4R)-2-cyano-4-fluoropyrrolidine-1- tert-butyl carboxylate
https://huagongshe.com/de/chemical/17856495
Identifikatoren & physikalische Daten
| CAS No. | 1330286-47-9 |
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| Summenformel | C10H15FN2O2 |
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| Durchschnittliche Molmasse | 214,24 g/mol |
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| SMILES | CC(C)(C)OC(=O)N1CC(F)CC1C#N |
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| InChIKey | QAKRZINKSNCLEV-UHFFFAOYSA-N |
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| PubChem CID | 17856495 |
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| EC No. | 813-734-9 |
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Chemische & physikalische Eigenschaften
| XLogP | 1,5 |
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| Polarare Oberfläche (TPSA) | 53,3 |
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| H-Brücken-Donoren | 0 |
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| H-Brücken-Akzeptoren | 4 |
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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 | 302 |
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| Siedepunkt | 316.7±42.0 °C(Predicted) |
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| Dichte | 1.15±0.1 g/cm3(Predicted) |
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| Lagerbedingungen | Storage temp. 2-8°C |
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| pKa (Säurekonstante) | -7.30±0.60(Predicted) |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P261, P264, P270, P272, P280, P301+P317, P302+P352, P321, P330, P333+P317, P362+P364, 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 | Acute Tox. 4 (100%) |
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| Zollcode | 2933998090 |
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| R-Sätze (R) | 43 |
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| Sicherheitshinweise (S) | 36/37 |
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