HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 11972Erstellt: 27. Oktober 2026
2-Acetamidophenol
Glycolanilide · Cetirizine Impurity 52 · Cinnarizine Impurity 52 · Hydroxyacetylaminobenzene · Diclofenac EP Impurity 13 · 2-Hydroxy-N-phenylacetamide · N-Phenyl-2-hydroxyacetamide · Diclofenac sodium impurity 1
https://huagongshe.com/de/chemical/11972
Identifikatoren & physikalische Daten
| CAS No. | 4746-61-6 |
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| Summenformel | C8H9NO2 |
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| Durchschnittliche Molmasse | 151,16 g/mol |
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| Monoisotopische Masse | 151,06332853 g/mol |
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| SMILES | CC(=O)Nc1ccccc1O |
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| InChIKey | ADVGKWPZRIDURE-UHFFFAOYSA-N |
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| PubChem CID | 11972 |
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| ChEMBL | CHEMBL1456301 |
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| ChEBI | CHEBI:143107 |
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| EC No. | 210-396-9 |
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| DTXSID | DTXSID8022082 |
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Chemische & physikalische Eigenschaften
| XLogP | 0,7 |
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| Polarare Oberfläche (TPSA) | 49,3 |
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| H-Brücken-Donoren | 2 |
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| H-Brücken-Akzeptoren | 2 |
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| Frei drehbare Bindungen | 1 |
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| Schwere Atome | 11 |
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| Formalladung | 0 |
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| Komplexität | 147 |
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| SpringerMaterials Properties | Chemical shift |
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| Collision Cross Section | 130.2 Ų [M-H]- [CCS Type: DTBuffer gas: N2Ionization: ESI-Dataset: TOXCASTSource Identifier: DTXSID8022082] |
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| Schmelzpunkt | 92 °C |
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| Siedepunkt | 273.17°C (rough estimate) |
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| Dichte | 1.2023 (rough estimate) |
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| Brechungsindex | 1.5810 (estimate) |
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| Lagerbedingungen | 2-8°C |
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| pKa (Säurekonstante) | 13.41±0.10(Predicted) |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH315 (98%): 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 49 reports by companies from 5 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 (98%) |
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| Alarmwort | Warnung |
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| Gefahrenhinweise | Code Gefahrenhinweise Gefahrenklasse Abteilung Alarmwort Symbol P-Code H302 |
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