HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 11615696Erstellt: 24. Oktober 2026
6-Iodoindoline
6-Iodoindoline · 2,3-Dihydro-6-iodo-1H-indole · 1H-Indole, 2,3-dihydro-6-iodo- · 6-Iodo-2,3-dihydro-1H-indole hydrochloride
https://huagongshe.com/de/chemical/11615696
Identifikatoren & physikalische Daten
| CAS No. | 115666-46-1 |
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| Summenformel | C8H8IN |
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| Durchschnittliche Molmasse | 245,06 g/mol |
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| SMILES | Ic1ccc2c(c1)NCC2 |
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| InChIKey | KGCBZEKELZUOFI-UHFFFAOYSA-N |
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| PubChem CID | 11615696 |
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| EC No. | 813-457-3 |
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Chemische & physikalische Eigenschaften
| XLogP | 2,6 |
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| Polarare Oberfläche (TPSA) | 12 |
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| H-Brücken-Donoren | 1 |
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| H-Brücken-Akzeptoren | 1 |
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| Frei drehbare Bindungen | 0 |
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| Schwere Atome | 10 |
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| Formalladung | 0 |
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| Komplexität | 126 |
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| Schmelzpunkt | 83-90 °C |
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| Siedepunkt | 289.6±29.0 °C(Predicted) |
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| Dichte | 1.793±0.06 g/cm3(Predicted) |
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| Lagerbedingungen | -20°C, sealed storage, away from moisture |
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| Aggregatzustand | powder |
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| pKa (Säurekonstante) | 4.37±0.20(Predicted) |
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| Farbe | Grey |
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| InChI | 1S/C8H8IN/c9-7-2-1-6-3-4-10-8(6)5-7/h1-2,5,10H,3-4H2 |
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| InChIKey | KGCBZEKELZUOFI-UHFFFAOYSA-N |
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| SMILES | IC1=CC=C2CCNC2=C1 |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, 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 | Acute Tox. 4 (100%) |
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| Zollcode | 2933998090 |
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| Lagerklasse | 11 - Combustible Solids |
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| Gefahrenklasse | Acute Tox. 4 Oral |
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