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HCID 72321Erstellt: 3. November 2026
6,7-Dihydro-2H,10H-[1,3]dioxolo[4,5-g][1,3]dioxolo[7,8]isoquinolino[3,2-a]isoquinolin-5-ium chloride
Q-100696 · NSC-119754 · Coptisine Hcl · Coptisin chloride · Coptisine choride · COPTISINE CHLORIDE · Coptisin chloride-RM · COPTISINE CHLORIDE(P)
https://huagongshe.com/de/chemical/72321
Identifikatoren & physikalische Daten
| CAS No. | 6020-18-4 |
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| Summenformel | C19H14ClNO4 |
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| Durchschnittliche Molmasse | 355,777 g/mol |
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| Monoisotopische Masse | 355,06113561 g/mol |
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| SMILES | [Cl-].c1c2c(cc3c1OCO3)-c1cc3ccc4c(c3c[n+]1CC2)OCO4 |
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| InChIKey | LUXPUVKJHVUJAV-UHFFFAOYSA-M |
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| PubChem CID | 72321 |
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| ChEMBL | CHEMBL498722 |
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| ChEBI | CHEBI:228857 |
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| EC No. | 611-948-5 |
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| DTXSID | DTXSID00975628 |
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Chemische & physikalische Eigenschaften
| Schmelzpunkt | >258°C (dec.) |
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| Lagerbedingungen | Inert atmosphere,2-8°C |
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| Löslichkeit | DMSO (Slightly), Methanol (Slightly, Sonicated) |
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| Aggregatzustand | Solid |
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| Farbe | Orange to Dark Orange |
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| Stabilität | Hygroscopic |
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| Hauptanwendungen | metabolomicsvitamins, nutraceuticals, and natural products |
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| InChI | InChI=1S/C19H14NO4.ClH/c1-2-16-19(24-10-21-16)14-8-20-4-3-12-6-17-18(23-9-22-17)7-13(12)15(20)5-11(1)14/h1-2,5-8H,3-4,9-10H21H/q+1/p-1 |
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| InChIKey | LUXPUVKJHVUJAV-UHFFFAOYSA-M |
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| SMILES | C12=CC3=C(C4OCOC=4C=C3)C=[N+]1CCC1C=C3OCOC3=CC2=1.[Cl-] |
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Sicherheit & Vorschriften
| Wassergefährdungsklasse (WGK) | WGK 3 |
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| Lagerklasse | 6.1A - Combustible acute toxic Cat. 1 and 2very toxic hazardous materials |
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| Gefahrenklasse | Acute Tox. 2 InhalationAcute Tox. 2 Oral |
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![Molekülstruktur von 6,7-Dihydro-2H,10H-[1,3]dioxolo[4,5-g][1,3]dioxolo[7,8]isoquinolino[3,2-a]isoquinolin-5-ium chloride](/img/chemical/72321.png)