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HCID 332255Erstellt: 27. Oktober 2026
3,4,5,6-Tetrahydro-2H-cyclopenta(d)(1,3)thiazol-2-imine
AKOS BB-9240 · AKOS BBS-00002729 · TIMTEC-BB SBB005653 · 5,6-Dihydro-4H-cyclopentathiazol-2-amine · 2-AMINO-5,6-DIHYDRO-4H-CYCLOPENTATHIAZOLE · 4H-Cyclopentathiazol-2-amine, 5,6-dihydro- · 4H,5H,6H-cyclopenta[d][1,3]thiazol-2-amine · 5,6-Dihydro-4H-cyclopentathiazol-2-ylamine
https://huagongshe.com/de/chemical/332255
Identifikatoren & physikalische Daten
| CAS No. | 53051-97-1 |
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| Summenformel | C6H8N2S |
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| Durchschnittliche Molmasse | 140,21 g/mol |
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| Monoisotopische Masse | 140,04081926 g/mol |
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| SMILES | Nc1nc2c(s1)CCC2 |
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| InChIKey | HUKBELGUWQLEFD-UHFFFAOYSA-N |
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| PubChem CID | 332255 |
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| ChEMBL | CHEMBL5219638 |
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| EC No. | 671-528-2 |
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| DTXSID | DTXSID20201092 |
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Chemische & physikalische Eigenschaften
| XLogP | 1,2 |
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| Polarare Oberfläche (TPSA) | 67,2 |
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| H-Brücken-Donoren | 1 |
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| H-Brücken-Akzeptoren | 3 |
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| Frei drehbare Bindungen | 0 |
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| Schwere Atome | 9 |
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| Formalladung | 0 |
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| Komplexität | 118 |
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| Schmelzpunkt | 96-99°C |
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| Siedepunkt | 295.5±9.0 °C(Predicted) |
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| Dichte | 1.354±0.06 g/cm3(Predicted) |
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| Lagerbedingungen | 2-8°C(protect from light) |
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| pKa (Säurekonstante) | 6.02±0.20(Predicted) |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, 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 | 2934999090 |
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