HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 285756Erstellt: 27. Oktober 2026
1-Benzyl-5-Bromo-1H-Indole
1-BENZYL-5-BROMOINDOLE · Indole, 1-benzyl-5-bromo- · 1-Benzyl-5-bromo-1H-indole · 1H-Indole, 5-bromo-1-(phenylmethyl)-
https://huagongshe.com/de/chemical/285756
Identifikatoren & physikalische Daten
| CAS No. | 10075-51-1 |
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| Summenformel | C15H12BrN |
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| Durchschnittliche Molmasse | 286,17 g/mol |
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| Monoisotopische Masse | 285,01531 g/mol |
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| SMILES | Brc1ccc2c(ccn2Cc2ccccc2)c1 |
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| InChIKey | AQXJFUYUNHLBGU-UHFFFAOYSA-N |
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| PubChem CID | 285756 |
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| EC No. | 107-212-3 |
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| DTXSID | DTXSID10301419 |
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Chemische & physikalische Eigenschaften
| XLogP | 4,3 |
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| Polarare Oberfläche (TPSA) | 4,9 |
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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 | 17 |
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| Formalladung | 0 |
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| Komplexität | 249 |
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| Schmelzpunkt | 93-95 °C |
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| Siedepunkt | 425.3±28.0 °C(Predicted) |
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| Dichte | 1.35±0.1 g/cm3(Predicted) |
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| Lagerbedingungen | 2-8°C(protect from light) |
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| Aggregatzustand | powder to crystal |
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| Farbe | White to Almost white |
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| InChI | 1S/C15H12BrN/c16-14-6-7-15-13(10-14)8-9-17(15)11-12-4-2-1-3-5-12/h1-10H,11H2 |
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| InChIKey | AQXJFUYUNHLBGU-UHFFFAOYSA-N |
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| SMILES | BrC1=CC=C2C(C=CN2CC3=CC=CC=C3)=C1 |
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Sicherheit & Vorschriften
| GHS-Einstufung | DangerH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]P264, P264+P265, P270, P280, P301+P317, P305+P354+P338, P317, P330, 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%)Eye Dam. 1 (100%) |
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| Wassergefährdungsklasse (WGK) | WGK 3 |
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| Zollcode | 2933.99.8290 |
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| R-Sätze (R) | 41 |
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| Sicherheitshinweise (S) | 26-39 |
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| Lagerklasse | 11 - Combustible Solids |
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| Gefahrenklasse | Acute Tox. 4 OralEye Dam. 1 |
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