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HCID 76856Erstellt: 26. Oktober 2026
Methyl-3,5-dichlor-4-hydroxybenzoat
AURORA 17218 · RARECHEM AL BF 0933 · LABOTEST-BB LT00455579 · Methyl 3,5-dichloro-4-hydroxybenzoate · METHYL-4-HYDROXY-3 5-DICHLOROBENZOATE · Methyl 3,5-Dichloro-4-Hydroxylbenzoate · 4-HYDROXY-3,5-DICHLOROBENZOIC ACID METHYL ESTER · 3,5-DICHLORO-4-HYDROXYBENZOIC ACID METHYL ESTER
https://huagongshe.com/de/chemical/76856
Identifikatoren & physikalische Daten
| CAS No. | 3337-59-5 |
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| Summenformel | C8H6Cl2O3 |
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| Durchschnittliche Molmasse | 221,03 g/mol |
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| Monoisotopische Masse | 219,96939941 g/mol |
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| SMILES | COC(=O)c1cc(Cl)c(O)c(Cl)c1 |
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| InChIKey | UKMOOQFHBGTLAO-UHFFFAOYSA-N |
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| PubChem CID | 76856 |
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| ChEBI | CHEBI:218055 |
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| EC No. | 222-074-5 |
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| DTXSID | DTXSID20186991 |
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| Lokaler Name | Methyl-3,5-dichlor-4-hydroxybenzoat |
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Chemische & physikalische Eigenschaften
| XLogP | 2,8 |
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| Polarare Oberfläche (TPSA) | 46,5 |
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| H-Brücken-Donoren | 1 |
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| H-Brücken-Akzeptoren | 3 |
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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 | 186 |
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| Endocrine Disruptors | Potential endocrine disrupting compound |
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| Schmelzpunkt | 122-125°C |
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| Siedepunkt | 340.99°C (rough estimate) |
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| Dichte | 1.4760 (rough estimate) |
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| Brechungsindex | 1.4800 (estimate) |
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| Lagerbedingungen | Sealed in dry,Room Temperature |
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| pKa (Säurekonstante) | 5.43±0.23(Predicted) |
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| CAS Datenbank | 3337-59-5(CAS DataBase Reference) |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
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| Hazard Classes and Categories | Skin Irrit. 2 (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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