HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 2740366Erstellt: 4. November 2026
3-Bromothiophene-2-carbothioamide
3-BROMOTHIOPHENE-2-CARBOTHIOAMIDE · 3-Bromo-2-thiophenecarbothioamide · 2-Thiophenecarbothioamide, 3-bromo-
https://huagongshe.com/de/chemical/2740366
Identifikatoren & physikalische Daten
| CAS No. | 256529-47-2 |
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| Summenformel | C5H4BrNS2 |
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| Durchschnittliche Molmasse | 222,1 g/mol |
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| Monoisotopische Masse | 220,89685 g/mol |
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| SMILES | NC(=S)c1sccc1Br |
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| InChIKey | LJHCNGDJUDDXLP-UHFFFAOYSA-N |
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| PubChem CID | 2740366 |
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| EC No. | 100-009-0 |
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| DTXSID | DTXSID80372373 |
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Chemische & physikalische Eigenschaften
| XLogP | 2,1 |
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| Polarare Oberfläche (TPSA) | 86,4 |
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| H-Brücken-Donoren | 1 |
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| H-Brücken-Akzeptoren | 2 |
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| Frei drehbare Bindungen | 1 |
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| Schwere Atome | 9 |
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| Formalladung | 0 |
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| Komplexität | 128 |
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| Siedepunkt | 324.1±52.0 °C(Predicted) |
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| Dichte | 1.825±0.06 g/cm3(Predicted) |
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| pKa (Säurekonstante) | 12.07±0.29(Predicted) |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, 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 | Acute Tox. 4 (100%) |
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