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HCID 79765Erstellt: 4. November 2026
2,5,6-Trimethylbenzothiazol
2,5,6-Trimethylbenzthiazole · 2,5,6-TRIMETHYLBENZOTHIAZOLE · 2,5,6-TriMethylbenzo[d]thiazole · Benzothiazole, 2,5,6-trimethyl- · 2,5,6-Trimethylbenzothiazole,99% · 2,5,6-Trimethyl-1,3-benzothiazole · N-methylacetonitrilium hexafluorophosphate · 2,5,6-Trimethylbenzothiazole in stock Factory
https://huagongshe.com/de/chemical/79765
Identifikatoren & physikalische Daten
| CAS No. | 5683-41-0 |
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| Summenformel | C10H11NS |
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| Durchschnittliche Molmasse | 177,27 g/mol |
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| Monoisotopische Masse | 177,06122053 g/mol |
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| SMILES | Cc1nc2cc(C)c(C)cc2s1 |
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| InChIKey | ZZLZXZFVVOXVRG-UHFFFAOYSA-N |
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| PubChem CID | 79765 |
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| ChEMBL | CHEMBL1339665 |
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| EC No. | 227-148-0 |
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| DTXSID | DTXSID70205368 |
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| Lokaler Name | 2,5,6-Trimethylbenzothiazol |
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Chemische & physikalische Eigenschaften
| XLogP | 3,5 |
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| Polarare Oberfläche (TPSA) | 41,1 |
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| H-Brücken-Donoren | 0 |
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| H-Brücken-Akzeptoren | 2 |
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| Frei drehbare Bindungen | 0 |
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| Schwere Atome | 12 |
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| Formalladung | 0 |
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| Komplexität | 171 |
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| Löslichkeit | 0.7 [ug/mL] (The mean of the results at pH 7.4)insoluble |
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| Schmelzpunkt | 81-85 °C |
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| Siedepunkt | 143 °C / 5mmHg |
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| Dichte | 1.0293 (rough estimate) |
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| Brechungsindex | 1.5500 (estimate) |
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| Lagerbedingungen | Sealed in dry,Room Temperature |
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| Aggregatzustand | powder to crystal |
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| pKa (Säurekonstante) | 2.49±0.10(Predicted) |
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| Farbe | White to Light red to Green |
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| CAS Datenbank | 5683-41-0(CAS DataBase Reference) |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]P264, P264+P265, P270, P280, P301+P317, P302+P352, P305+P351+P338, P321, P330, P332+P317, P337+P317, P362+P364, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 2 reports by companies from 2 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 (50%) |
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| Zollcode | 2934208090 |
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| R-Sätze (R) | 36/37/38-20/21/22 |
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| Gefahrensymbole | Xn |
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| Sicherheitshinweise (S) | 36/37/39-26 |
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