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HCID 393988Erstellt: 27. Oktober 2026
2-[(4-chlorophenoxy)methyl]-1H-1,3-benzodiazole
2-(4-Chloro-phenoxymethyl)-1H-benzoimidazole · 1-(benzimidazol-2-ylmethoxy)-4-chlorobenzene · 2-(4-Chlorophenoxymethyl)-1H-1,3-benzodiazole · 1H-Benzimidazole, 2-[(4-chlorophenoxy)methyl]- · 2-((4-chlorophenoxy)methyl)-1H-benzo[d]imidazole
https://huagongshe.com/de/chemical/393988
Identifikatoren & physikalische Daten
| CAS No. | 3156-18-1 |
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| Summenformel | C14H11ClN2O |
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| Durchschnittliche Molmasse | 258,7 g/mol |
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| Monoisotopische Masse | 258,0559907 g/mol |
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| SMILES | Clc1ccc(OCc2nc3ccccc3[nH]2)cc1 |
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| InChIKey | ITCRYYSSWFKZJM-UHFFFAOYSA-N |
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| PubChem CID | 393988 |
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| ChEMBL | CHEMBL355280 |
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| EC No. | 103-257-8 |
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| DTXSID | DTXSID00327860 |
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Chemische & physikalische Eigenschaften
| XLogP | 3,9 |
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| Polarare Oberfläche (TPSA) | 37,9 |
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| H-Brücken-Donoren | 1 |
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| H-Brücken-Akzeptoren | 2 |
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| Frei drehbare Bindungen | 3 |
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| Schwere Atome | 18 |
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| Formalladung | 0 |
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| Komplexität | 269 |
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| Schmelzpunkt | 174 °C |
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| Siedepunkt | 496.6±25.0 °C(Predicted) |
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| Dichte | 1.349±0.06 g/cm3(Predicted) |
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| pKa (Säurekonstante) | 11.34±0.10(Predicted) |
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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 H302 |
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![Molekülstruktur von 2-[(4-chlorophenoxy)methyl]-1H-1,3-benzodiazole](/img/chemical/393988.png)