HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 243167Erstellt: 26. Oktober 2026
3-(Cyanomethyl)pyridin-1-ium-1-olate
3-Pyridineacetonitrile, 1-oxide · (1-Oxy-pyridin-3-yl)-acetonitrile · 3-(CYANOMETHYL)-1-PYRIDINIUMOLATE · 3-(Cyanomethyl)pyridin-1-ium-1-olate · 2-(1-oxidopyridin-1-ium-3-yl)acetonitrile
https://huagongshe.com/de/chemical/243167
Identifikatoren & physikalische Daten
| CAS No. | 6635-88-7 |
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| Summenformel | C7H6N2O |
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| Durchschnittliche Molmasse | 134,14 g/mol |
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| Monoisotopische Masse | 134,04801282 g/mol |
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| SMILES | N#CCc1ccc[n+]([O-])c1 |
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| InChIKey | OGPFILFOKYMAKO-UHFFFAOYSA-N |
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| PubChem CID | 243167 |
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| EC No. | 800-216-2 |
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| DTXSID | DTXSID40287772 |
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Chemische & physikalische Eigenschaften
| XLogP | -0,5 |
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| Polarare Oberfläche (TPSA) | 49,3 |
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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 | 10 |
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| Formalladung | 0 |
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| Komplexität | 149 |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]P261, P264, P270, P271, P280, P301+P317, P302+P352, P304+P340, P317, P321, P330, P362+P364, 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 | 2933399990 |
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