HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 83854635Erstellt: 31. Oktober 2026
5-Chloro-2-(difluoromethyl)benzoic acid
5-chloro-2-(difluoromethyl)benzoic acid · Benzoic acid, 5-chloro-2-(difluoromethyl)-
https://huagongshe.com/de/chemical/83854635
Identifikatoren & physikalische Daten
| CAS No. | 1551365-62-8 |
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| Summenformel | C8H5ClF2O2 |
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| Durchschnittliche Molmasse | 206,57 g/mol |
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| Monoisotopische Masse | 205,9946134 g/mol |
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| SMILES | O=C(O)c1cc(Cl)ccc1C(F)F |
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| InChIKey | CWBCRDIQYKBTEP-UHFFFAOYSA-N |
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| PubChem CID | 83854635 |
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| EC No. | 974-100-6 |
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Chemische & physikalische Eigenschaften
| XLogP | 2,7 |
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| Polarare Oberfläche (TPSA) | 37,3 |
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| H-Brücken-Donoren | 1 |
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| H-Brücken-Akzeptoren | 4 |
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| Frei drehbare Bindungen | 2 |
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| Schwere Atome | 13 |
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| Formalladung | 0 |
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| Komplexität | 199 |
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| Siedepunkt | 302.5±42.0 °C(Predicted) |
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| Dichte | 1.456±0.06 g/cm3(Predicted) |
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| pKa (Säurekonstante) | 3.05±0.36(Predicted) |
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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, 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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