HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 1474471Erstellt: 27. Oktober 2026
6-Bromo-1-benzofuran-2-carboxylic acid
6-BROMOBENZOFURAN-2-CARBOXYLIC ACID · 6-bromo-2-Benzofurancarboxylic acid · 2-Benzofurancarboxylic acid, 6-broMo- · 6-Bromo-1-benzofuran-2-carboxylic acid
https://huagongshe.com/de/chemical/1474471
Identifikatoren & physikalische Daten
| CAS No. | 439107-94-5 |
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| Summenformel | C9H5BrO3 |
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| Durchschnittliche Molmasse | 241,04 g/mol |
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| Monoisotopische Masse | 239,94220612 g/mol |
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| SMILES | O=C(O)c1cc2ccc(Br)cc2o1 |
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| InChIKey | ULBSHNJYWRMJRZ-UHFFFAOYSA-N |
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| PubChem CID | 1474471 |
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| EC No. | 830-951-4 |
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| DTXSID | DTXSID70363053 |
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Chemische & physikalische Eigenschaften
| XLogP | 3,1 |
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| Polarare Oberfläche (TPSA) | 50,4 |
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| H-Brücken-Donoren | 1 |
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| H-Brücken-Akzeptoren | 3 |
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| Frei drehbare Bindungen | 1 |
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| Schwere Atome | 13 |
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| Formalladung | 0 |
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| Komplexität | 219 |
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| Lagerbedingungen | 2-8°C |
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| InChI | InChI=1S/C9H5BrO3/c10-6-2-1-5-3-8(9(11)12)13-7(5)4-6/h1-4H,(H,11,12) |
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| InChIKey | ULBSHNJYWRMJRZ-UHFFFAOYSA-N |
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| SMILES | O1C2=CC(Br)=CC=C2C=C1C(O)=O |
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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 | 2932990090 |
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