HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 594375Erstellt: 27. Oktober 2026
7-Methoxyisoquinoline
7-Methoxy-isoquinoline · Isoquinoline, 7-methoxy- · 7-Methoxyisoquinoline 96% · 7-Methoxy-2-azanaphthalene · 7-Methoxyisoquinoline - [M9820] · 7-METHOXY-ISOQUINOLINE ISO 9001：2015 REACH
https://huagongshe.com/de/chemical/594375
Identifikatoren & physikalische Daten
| CAS No. | 39989-39-4 |
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| Summenformel | C10H9NO |
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| Durchschnittliche Molmasse | 159,18 g/mol |
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| Monoisotopische Masse | 159,06841391 g/mol |
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| SMILES | COc1ccc2ccncc2c1 |
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| InChIKey | PNNUXNXZDJVGSB-UHFFFAOYSA-N |
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| PubChem CID | 594375 |
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| EC No. | 640-558-8 |
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| DTXSID | DTXSID30344085 |
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Chemische & physikalische Eigenschaften
| XLogP | 2,2 |
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| Polarare Oberfläche (TPSA) | 22,1 |
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| H-Brücken-Donoren | 0 |
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| H-Brücken-Akzeptoren | 2 |
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| Frei drehbare Bindungen | 1 |
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| Schwere Atome | 12 |
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| Formalladung | 0 |
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| Komplexität | 149 |
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| Schmelzpunkt | 49°C |
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| Siedepunkt | 284.68°C (rough estimate) |
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| Dichte | 1.1202 (rough estimate) |
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| Brechungsindex | 1.6070 (estimate) |
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| Lagerbedingungen | Sealed in dry,Room Temperature |
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| pKa (Säurekonstante) | 5.54±0.10(Predicted) |
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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, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
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| Hazard Classes and Categories | Acute Tox. 4 (100%) |
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| Zollcode | 2933499090 |
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| R-Sätze (R) | 22 |
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| Gefahrensymbole | Xi,Xn |
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| hazard_note | Irritant |
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