HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 97813Erstellt: 25. Oktober 2026
β-Bromcumol
(1-broMopropan-2-yl)benzene · B-BROMOCUMENE · 8-Bromocumene · β-Bromocumene · beta-Bromocumene · Cumene, beta-bromo- · Bromoisopropylbenzene · 2-Phenylpropyl bromide
https://huagongshe.com/de/chemical/97813
Identifikatoren & physikalische Daten
| CAS No. | 1459-00-3 |
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| Summenformel | C9H11Br |
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| Durchschnittliche Molmasse | 199,09 g/mol |
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| Monoisotopische Masse | 198,00441245 g/mol |
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| SMILES | CC(CBr)c1ccccc1 |
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| InChIKey | XJWVCWQKZQENDS-UHFFFAOYSA-N |
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| PubChem CID | 97813 |
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| EC No. | 215-948-2 |
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| DTXSID | DTXSID50870876 |
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| Lokaler Name | β-Bromcumol |
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Chemische & physikalische Eigenschaften
| XLogP | 3,9 |
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| Polarare Oberfläche (TPSA) | 0 |
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| H-Brücken-Donoren | 0 |
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| H-Brücken-Akzeptoren | 0 |
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| Frei drehbare Bindungen | 2 |
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| Schwere Atome | 10 |
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| Formalladung | 0 |
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| Komplexität | 84,7 |
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| SpringerMaterials Properties | Optical coefficient |
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| Schmelzpunkt | -59.3°C |
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| Siedepunkt | 115-116°C 15mm |
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| Dichte | 1,314 g/cm3 |
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| Brechungsindex | 1.5470 |
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| Flammpunkt | 90°C |
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| Lagerbedingungen | Refrigerator, under inert atmosphere |
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| Löslichkeit | Chloroform, Ethanol, Methanol |
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| Aggregatzustand | Oil |
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| Farbe | Clear Dark Yellow |
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| BRN | 1931254 |
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| CAS Datenbank | 1459-00-3(CAS DataBase Reference) |
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Sicherheit & Vorschriften
| GHS-Einstufung | DangerH302 (88.9%): Harmful if swallowed [Warning Acute toxicity, oral]P233, P260, P264, P264+P265, P270, P271, P280, P284, P301+P317, P302+P352, P304+P340, P305+P351+P338, P321, P330, P332+P317, P337+P317, P342+P316, P362+P364, P403, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 45 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
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| Regulatorische Informationen | beta-Bromocumene: Does not have an individual approval but may be used under an appropriate group standard |
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| Hazard Classes and Categories | Acute Tox. 4 (88.9%) |
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| R-Sätze (R) | 36/38 |
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| Sicherheitshinweise (S) | 26-36 |
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