HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 13621613Erstellt: 27. Oktober 2026
4-Methoxy-3-methylbenzonitrile
4-Cyano-2-methylanisole · 4-methoxy-3-methylbenzonitrile · Benzonitrile, 4-methoxy-3-methyl- · 4-Methoxy-3-methylbenzonitrile≥ 98% (HPLC)
https://huagongshe.com/de/chemical/13621613
Identifikatoren & physikalische Daten
| CAS No. | 53078-71-0 |
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| Summenformel | C9H9NO |
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| Durchschnittliche Molmasse | 147,17 g/mol |
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| Monoisotopische Masse | 147,06841391 g/mol |
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| SMILES | COc1ccc(C#N)cc1C |
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| InChIKey | NMVJHSDSGDKQIR-UHFFFAOYSA-N |
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| PubChem CID | 13621613 |
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| EC No. | 154-563-3 |
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Chemische & physikalische Eigenschaften
| XLogP | 2,5 |
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| Polarare Oberfläche (TPSA) | 33 |
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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 | 11 |
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| Formalladung | 0 |
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| Komplexität | 170 |
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| Lagerbedingungen | Sealed in dry,Room Temperature |
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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)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 | 2926907090 |
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