HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 21504Erstellt: 26. Oktober 2026
2,6-Benzothiazolediamine
2,6-Diaminobenzothiazole · Benzo[d]thiazole-2,6-diaMine · Benzothiazole, 2,6-diamino- · 6-Amino-2-aminobenzothiazole · 2,6-Diamine-benzo[d]thiazole · 2,6-Benzothiazolediamine(9CI) · 2,6-Diaminobenzo[d]thiazole, 97% · (2-amino-1,3-benzothiazol-6-yl)amine
https://huagongshe.com/de/chemical/21504
Identifikatoren & physikalische Daten
| CAS No. | 5407-51-2 |
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| Summenformel | C7H7N3S |
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| Durchschnittliche Molmasse | 165,22 g/mol |
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| Monoisotopische Masse | 165,03606822 g/mol |
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| SMILES | Nc1ccc2nc(N)sc2c1 |
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| InChIKey | HYBCFWFWKXJYFT-UHFFFAOYSA-N |
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| PubChem CID | 21504 |
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| ChEMBL | CHEMBL328540 |
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| EC No. | 675-462-5 |
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| DTXSID | DTXSID70202397 |
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Chemische & physikalische Eigenschaften
| XLogP | 1,3 |
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| Polarare Oberfläche (TPSA) | 93,2 |
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| H-Brücken-Donoren | 2 |
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| H-Brücken-Akzeptoren | 4 |
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| Frei drehbare Bindungen | 0 |
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| Schwere Atome | 11 |
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| Formalladung | 0 |
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| Komplexität | 153 |
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| SpringerMaterials Properties | Chemical shift |
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| Schmelzpunkt | 207 °C |
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| Siedepunkt | 404.4±37.0 °C(Predicted) |
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| Dichte | 1.490±0.06 g/cm3(Predicted) |
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| Lagerbedingungen | 2-8°C(protect from light) |
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| Löslichkeit | Acetone (Slightly), DMSO (Slightly) |
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| Aggregatzustand | Solid |
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| pKa (Säurekonstante) | 5.78±0.10(Predicted) |
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| Farbe | Pale Brown to Light Brown |
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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)The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory. |
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| Hazard Classes and Categories | Skin Irrit. 2 (100%) |
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| Zollcode | 2934208090 |
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| Gefahrenklasse | IRRITANT |
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