HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
2-(4-Chlorphenoxy)ethanol
Fungisan · Mycotetracid · Chlorophetanol · Chloro-p-phenoxetol · 4-CHLOROPHENOXYETHANOL · 2-(4'-Chlorfenoxy)ethanol · 2-(4’-chlorfenoxy)ethanol · 2-(4-chlorophenoxy)-ethano
Identifikatoren & physikalische Daten
| CAS No. | 1892-43-9 |
|---|---|
| Summenformel | C8H9ClO2 |
| Durchschnittliche Molmasse | 172,61 g/mol |
| Monoisotopische Masse | 172,02910721 g/mol |
| SMILES | OCCOc1ccc(Cl)cc1 |
| InChIKey | GEGSSUSEWOHAFE-UHFFFAOYSA-N |
| PubChem CID | 15907 |
| ChEMBL | CHEMBL3707367 |
| ChEBI | CHEBI:135944 |
| EC No. | 217-578-7 |
| DTXSID | DTXSID1062047 |
| Lokaler Name | 2-(4-Chlorphenoxy)ethanol |
Chemische & physikalische Eigenschaften
| XLogP | 1,8 |
|---|---|
| Polarare Oberfläche (TPSA) | 29,5 |
| H-Brücken-Donoren | 1 |
| H-Brücken-Akzeptoren | 2 |
| Frei drehbare Bindungen | 3 |
| Schwere Atome | 11 |
| Formalladung | 0 |
| Komplexität | 100 |
| Arzneimittel | Pharmaceuticals -> Listed in ZINC15 |
| SpringerMaterials Properties | Boiling point |
| Schmelzpunkt | 30°C |
| Siedepunkt | 135-136°C 6mm |
| Dichte | 1.26 |
| Brechungsindex | 1.5510 |
| Flammpunkt | 135-136°C/6mm |
| Lagerbedingungen | 2-8°C |
| Aggregatzustand | powder to lump to clear liquid |
| pKa (Säurekonstante) | 14.18±0.10(Predicted) |
| Farbe | White or Colorless to Yellow |
| Löslichkeit | Soluble in water 3.1 g/L @ 25°C. |
| BRN | 1365684 |
| CAS Datenbank | 1892-43-9(CAS DataBase Reference) |
| EPA chemische Informationen | Ethanol, 2-(4-chlorophenoxy)- (1892-43-9) |
Sicherheit & Vorschriften
| GHS-Einstufung | DangerH302 (88.6%): Harmful if swallowed [Warning Acute toxicity, oral]P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 44 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Regulatorische Informationen | Chemical: Poly(oxy-1,2-ethanediyl), .alpha.-(4-chlorophenyl)-.omega.-hydroxy-Chemical: Ethanol, 2-(4-chlorophenoxy)-FRI - indicates a polymeric substance containing no free-radical initiator in its Inventory name but is considered to cover the designated polymer made with any free-radical initiator regardless of the amount used. |
| Weitere Sicherheitsinformationen | Evaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia |
| Hazard Classes and Categories | Acute Tox. 4 (88.6%) |
| TSCA-Inventar-Status | TSCA listed |
| UN-Transportnummer | 2811 |
| Zollcode | 2909.49.1500 |
| RTECS-Nr. | KK2100000 |
| R-Sätze (R) | 21/22-36/38 |
| Toxizität | rabbit,LD50,skin,500uL/kg (0.5mL/kg),American Industrial Hygiene Association Journal. Vol. 23, Pg. 95, 1962. |
| Sicherheitshinweise (S) | 23-36/37/39 |
| Gefahrenklasse | 6.1 |
| Verpackungsgruppe | III |
Anwendungen & Verwendung
Verwenden
2-(4-Chlorophenoxy)ethanol is used as a pharmaceutical intermediate.