HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 96165Erstellt: 27. Oktober 2026
3-Bromodiphenyl ether
1-Bromo-3-phenoxybenzene · PBDE 2 · BDE No2 · NSC 57095 · PBDE No. 2 · m-Phenoxybromobenzene · m-Bromophenoxybenzene · m-Bromodiphenyl ether
https://huagongshe.com/de/chemical/96165
Identifikatoren & physikalische Daten
| CAS No. | 6876-00-2 |
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| Summenformel | C12H9BrO |
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| Durchschnittliche Molmasse | 249,1 g/mol |
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| Monoisotopische Masse | 247,98367701 g/mol |
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| SMILES | Brc1cccc(Oc2ccccc2)c1 |
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| InChIKey | AHDAKFFMKLQPTD-UHFFFAOYSA-N |
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| PubChem CID | 96165 |
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| EC No. | 663-208-6 |
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| DTXSID | DTXSID9074773 |
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Chemische & physikalische Eigenschaften
| XLogP | 4,6 |
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| Polarare Oberfläche (TPSA) | 9,2 |
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| H-Brücken-Donoren | 0 |
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| H-Brücken-Akzeptoren | 1 |
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| Frei drehbare Bindungen | 2 |
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| Schwere Atome | 14 |
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| Formalladung | 0 |
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| Komplexität | 166 |
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| SpringerMaterials Properties | 13C nuclear magnetic resonance spectrum |
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| Siedepunkt | 200-203℃ (50 Torr) |
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| Dichte | 1.3944 g/cm3 (20℃) |
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| Brechungsindex | 1.6076 (589.3 nm 20℃) |
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| Flammpunkt | >110℃ |
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| Lagerbedingungen | Sealed in dry,Room Temperature |
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| Löslichkeit | Chloroform (Sparingly), Ethyl Acetate (Slightly), Methanol (Sparingly) |
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| Aggregatzustand | liquid |
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| Farbe | Colourless |
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| Henry-Konstante | 2.3×10-2 mol/(m3Pa) at 25℃, Long et al. (2017) |
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| InChI | 1S/C12H9BrO/c13-10-5-4-8-12(9-10)14-11-6-2-1-3-7-11/h1-9H |
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| InChIKey | AHDAKFFMKLQPTD-UHFFFAOYSA-N |
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| SMILES | Brc1cccc(Oc2ccccc2)c1 |
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| EPA chemische Informationen | PBDE 002 (6876-00-2) |
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Sicherheit & Vorschriften
| GHS-Einstufung | DangerH315 (97.5%): Causes skin irritation [Warning Skin corrosion/irritation]P261, P264, P264+P265, P271, P272, P273, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P332+P317, P333+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
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| Hazard Classes and Categories | Skin Irrit. 2 (97.5%) |
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| Wassergefährdungsklasse (WGK) | 3 |
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| UN-Transportnummer | UN 3077 9 / PGIII |
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| Zollcode | 2909303890 |
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| RTECS-Nr. | CY9040554 |
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| R-Sätze (R) | 37/38-41-43-51/53 |
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| Gefahrensymbole | Xi,N |
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| hazard_note | Irritant |
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| Sicherheitshinweise (S) | 26-36/37/39-61 |
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| Lagerklasse | 10 - Combustible liquids |
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| Gefahrenklasse | Aquatic Chronic 2Eye Dam. 1Skin Irrit. 2Skin Sens. 1STOT SE 3 |
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