HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 596459Erstellt: 2. November 2026
Methyl 5-acetylpyridine-3-carboxylate
5-Acetylnicotinic acid methyl ester · Methyl 5-acetylpyridine-3-carboxylate · 5-Acetyl-3-pyridinecarboxylic acid methyl ester · 3-Pyridinecarboxylic acid, 5-acetyl-, methyl ester
https://huagongshe.com/de/chemical/596459
Identifikatoren & physikalische Daten
| CAS No. | 38940-61-3 |
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| Summenformel | C9H9NO3 |
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| Durchschnittliche Molmasse | 179,17 g/mol |
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| Monoisotopische Masse | 179,05824315 g/mol |
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| SMILES | COC(=O)c1cncc(C(C)=O)c1 |
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| InChIKey | BUKCTHLVWBOTIE-UHFFFAOYSA-N |
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| PubChem CID | 596459 |
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| EC No. | 827-595-7 |
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| DTXSID | DTXSID90344389 |
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Chemische & physikalische Eigenschaften
| XLogP | 0,4 |
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| Polarare Oberfläche (TPSA) | 56,3 |
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| H-Brücken-Donoren | 0 |
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| H-Brücken-Akzeptoren | 4 |
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| Frei drehbare Bindungen | 3 |
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| Schwere Atome | 13 |
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| Formalladung | 0 |
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| Komplexität | 215 |
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| Lagerbedingungen | 2-8°C |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposureRespiratory tract irritation]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%)Skin Irrit. 2 (100%)Eye Irrit. 2A (100%)STOT SE 3 (100%) |
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| Alarmwort | Warnung |
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| Gefahrenhinweise | Code Gefahrenhinweise Gefahrenklasse Abteilung Alarmwort Symbol P-Code H315 |
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