HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 11264641Erstellt: 27. Oktober 2026
3-(Bromomethyl)-1-benzothiophene
3-(Bromomethyl)benzothiophene · 3-(Bromomethyl)-1-benzothiophene · 3-(Bromomethyl)benzo[b]thiophene · Benzo[b]thiophene, 3-(bromomethyl)-
https://huagongshe.com/de/chemical/11264641
Identifikatoren & physikalische Daten
| CAS No. | 1196-19-6 |
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| Summenformel | C9H7BrS |
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| Durchschnittliche Molmasse | 227,12 g/mol |
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| SMILES | BrCc1csc2ccccc12 |
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| InChIKey | WYKHJZSILIVQKU-UHFFFAOYSA-N |
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| PubChem CID | 11264641 |
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| EC No. | 831-411-0 |
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Chemische & physikalische Eigenschaften
| XLogP | 3,5 |
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| Polarare Oberfläche (TPSA) | 28,2 |
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| H-Brücken-Donoren | 0 |
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| H-Brücken-Akzeptoren | 1 |
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| Frei drehbare Bindungen | 1 |
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| Schwere Atome | 11 |
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| Formalladung | 0 |
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| Komplexität | 138 |
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| Siedepunkt | 311.3±17.0 °C(Predicted) |
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| Dichte | 1.593±0.06 g/cm3(Predicted) |
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| Lagerbedingungen | Inert atmosphere,Store in freezer, under -20°C |
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| Aggregatzustand | solid |
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| InChI | 1S/C9H7BrS/c10-5-7-6-11-9-4-2-1-3-8(7)9/h1-4,6H,5H2 |
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| InChIKey | WYKHJZSILIVQKU-UHFFFAOYSA-N |
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| SMILES | BrCC1=CSC2=C1C=CC=C2 |
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Sicherheit & Vorschriften
| GHS-Einstufung | DangerH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P260, P264, P270, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P330, P363, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 3 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 (100%) |
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| Zollcode | 2934208090 |
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| Lagerklasse | 11 - Combustible Solids |
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| Gefahrenklasse | Acute Tox. 4 Oral |
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