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HCID 90131Erstellt: 27. Oktober 2026
6-tert-Butyl-3-(chlormethyl)-2,4-xylenol
Butenafine Impurity 87 · Oxymetazoline Impurity 4 · Hydroxymethazoline impurity 10 · 6-tert-butyl-3-(chloromethyl)-2,4-xylenol · 2-(t-Butyl)-3-chloromethyl-4,6-dimethylphenol · 2-tert-Butyl-3-chloromethyl-4,6-dimethylphenol · 4-tert butyl-2,6-dimethyl-3-hydroxy benzyl chloride · 3-Chloromethyl-6-(1,1-dimethylethyl)-2,4-dimethylphenol
https://huagongshe.com/de/chemical/90131
Identifikatoren & physikalische Daten
| CAS No. | 23500-79-0 |
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| Summenformel | C13H19ClO |
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| Durchschnittliche Molmasse | 226,74 g/mol |
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| Monoisotopische Masse | 226,11244291 g/mol |
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| SMILES | Cc1cc(C(C)(C)C)c(O)c(C)c1CCl |
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| InChIKey | WODZSHMAILHEGD-UHFFFAOYSA-N |
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| PubChem CID | 90131 |
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| EC No. | 245-697-4 |
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| DTXSID | DTXSID3027827 |
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| Lokaler Name | 6-tert-Butyl-3-(chlormethyl)-2,4-xylenol |
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Chemische & physikalische Eigenschaften
| XLogP | 4,4 |
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| Polarare Oberfläche (TPSA) | 20,2 |
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| H-Brücken-Donoren | 1 |
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| H-Brücken-Akzeptoren | 1 |
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| Frei drehbare Bindungen | 2 |
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| Schwere Atome | 15 |
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| Formalladung | 0 |
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| Komplexität | 209 |
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| Physical Description | Liquid |
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| Siedepunkt | 312.9±37.0 °C(Predicted) |
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| Dichte | 1.055±0.06 g/cm3(Predicted) |
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| pKa (Säurekonstante) | 11.65±0.28(Predicted) |
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| EPA chemische Informationen | Phenol, 3-(chloromethyl)-6-(1,1-dimethylethyl)-2,4-dimethyl- (23500-79-0) |
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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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| Regulatorische Informationen | Phenol, 3-(chloromethyl)-6-(1,1-dimethylethyl)-2,4-dimethyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Phenol, 3-(chloromethyl)-6-(1,1-dimethylethyl)-2,4-dimethyl- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711) |
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| Hazard Classes and Categories | Acute Tox. 4 (100%) |
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| TSCA-Inventar-Status | TSCA listed |
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