HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 6420004Erstellt: 2. November 2026
Dequalinium chloride hydrate
Dequalinium chloride hydrate >=95% (titration)
https://huagongshe.com/de/chemical/6420004
Identifikatoren & physikalische Daten
| CAS No. | 1255077-34-9 |
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| Summenformel | C30H42Cl2N4O |
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| Durchschnittliche Molmasse | 545,6 g/mol |
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| Monoisotopische Masse | 544,2735674 g/mol |
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| SMILES | Cc1cc(N)c2ccccc2[n+]1CCCCCCCCCC[n+]1c(C)cc(N)c2ccccc21.O.[Cl-].[Cl-] |
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| InChIKey | CZCJAGQJOXJBST-UHFFFAOYSA-N |
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| PubChem CID | 6420004 |
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| EC No. | 803-026-8 |
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Chemische & physikalische Eigenschaften
| Polarare Oberfläche (TPSA) | 60,8 |
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| H-Brücken-Donoren | 3 |
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| H-Brücken-Akzeptoren | 5 |
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| Frei drehbare Bindungen | 11 |
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| Schwere Atome | 37 |
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| Formalladung | 0 |
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| Komplexität | 532 |
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| Schmelzpunkt | ≥300°C (lit.) |
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| Aggregatzustand | powder |
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| InChIKey | CZCJAGQJOXJBST-UHFFFAOYSA-N |
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| SMILES | O.[Cl-].[Cl-].Cc1cc(N)c2ccccc2[n+]1CCCCCCCCCC[n+]3c(C)cc(N)c4ccccc34 |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH315 (100%): Causes skin irritation [Warning Skin corrosion/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)Aggregated GHS information provided per 38 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 | Skin Irrit. 2 (100%) |
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| Wassergefährdungsklasse (WGK) | 3 |
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| RTECS-Nr. | VA0700000 |
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| R-Sätze (R) | 36/37/38 |
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| Gefahrensymbole | Xi |
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| Sicherheitshinweise (S) | 26-36 |
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| Lagerklasse | 11 - Combustible Solids |
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| Gefahrenklasse | Eye Irrit. 2Skin Irrit. 2STOT SE 3 |
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