HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 91613Erstellt: 31. Oktober 2026
2-Methylhistamine
2-methylhistamine · 2-Methyl-1H-imidazole-4-ethanamine · 1H-Imidazole-5-ethanamine, 2-methyl- · 2-(2-Methyl-1H-imidazol-4-yl)ethanamine · 2-(2-Methyl-1H-imidazol-4-yl)-ethylamine · 2-(2-Methyl-1h-imidazol-5-yl)ethan-1-amine
https://huagongshe.com/de/chemical/91613
Identifikatoren & physikalische Daten
| CAS No. | 34392-54-6 |
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| Summenformel | C6H11N3 |
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| Durchschnittliche Molmasse | 125,17 g/mol |
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| Monoisotopische Masse | 125,09529736 g/mol |
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| SMILES | Cc1ncc(CCN)[nH]1 |
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| InChIKey | XDKYTXBAVJELDQ-UHFFFAOYSA-N |
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| PubChem CID | 91613 |
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| ChEMBL | CHEMBL12620 |
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| ChEBI | CHEBI:74761 |
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| EC No. | 175-755-3 |
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| DTXSID | DTXSID00187966 |
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Chemische & physikalische Eigenschaften
| XLogP | -0,2 |
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| Polarare Oberfläche (TPSA) | 54,7 |
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| H-Brücken-Donoren | 2 |
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| H-Brücken-Akzeptoren | 2 |
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| Frei drehbare Bindungen | 2 |
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| Schwere Atome | 9 |
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| Formalladung | 0 |
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| Komplexität | 84,4 |
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| Siedepunkt | 347.5±17.0 °C(Predicted) |
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| Dichte | 1.100±0.06 g/cm3(Predicted) |
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| pKa (Säurekonstante) | 14.96±0.10(Predicted) |
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Sicherheit & Vorschriften
| GHS-Einstufung | DangerH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P260, P261, P264, P270, P271, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P319, P321, P330, P363, 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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