HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
4-Chlor-o-anisidin
4-Chloro-2-methoxyaniline · 4-CHLORO-O-ANISIDINE · p-Chloro-o-anisidine · 2-Amino-5-chloroanisole · 2-Methoxy-4-chloroaniline · 4-Chloro-o-anisidine (NH2=1) · 4-Chloro-2-methoxyaniline 98% · 4-chloro-2-methoxy-benzenamin
Identifikatoren & physikalische Daten
| CAS No. | 93-50-5 |
|---|---|
| Summenformel | C7H8ClNO |
| Durchschnittliche Molmasse | 157,6 g/mol |
| Monoisotopische Masse | 157,0294416 g/mol |
| SMILES | COc1cc(Cl)ccc1N |
| InChIKey | WOXLPNAOCCIZGP-UHFFFAOYSA-N |
| PubChem CID | 7143 |
| EC No. | 202-251-3 |
| DTXSID | DTXSID5059088 |
| Lokaler Name | 4-Chlor-o-anisidin |
Chemische & physikalische Eigenschaften
| XLogP | 1,9 |
|---|---|
| Polarare Oberfläche (TPSA) | 35,3 |
| H-Brücken-Donoren | 1 |
| H-Brücken-Akzeptoren | 2 |
| Frei drehbare Bindungen | 1 |
| Schwere Atome | 10 |
| Formalladung | 0 |
| Komplexität | 110 |
| Schmelzpunkt | 52°C |
| Siedepunkt | 260°C (rough estimate) |
| Dichte | 1.1760 (rough estimate) |
| Brechungsindex | 1.5430 (estimate) |
| Lagerbedingungen | Keep in dark place,Inert atmosphere,2-8°C |
| Löslichkeit | Chloroform (Slightly), Methanol (Slightly) |
| pKa (Säurekonstante) | 3.90±0.10(Predicted) |
| Aggregatzustand | Solid |
| Farbe | Dark Brown |
| CAS Datenbank | 93-50-5(CAS DataBase Reference) |
| EPA chemische Informationen | Benzenamine, 4-chloro-2-methoxy- (93-50-5) |
Sicherheit & Vorschriften
| GHS-Einstufung | WarningH302 (25%): Harmful if swallowed [Warning Acute toxicity, oral]H315 (75%): Causes skin irritation [Warning Skin corrosion/irritation]H317 (25%): May cause an allergic skin reaction [Warning Sensitization, Skin]H319 (75%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]H335 (75%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposureRespiratory tract irritation]H411 (25%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]P261, P264, P264+P265, P270, P271, P272, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 4 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.Not Classified |
|---|---|
| Hazard Classes and Categories | Acute Tox. 4 (25%)Skin Irrit. 2 (75%)Skin Sens. 1 (25%)Eye Irrit. 2A (75%)STOT SE 3 (75%)Aquatic Chronic 2 (25%) |
| TSCA-Inventar-Status | TSCA listed |
| Zollcode | 2921420090 |
| R-Sätze (R) | 43 |
| Gefahrensymbole | Xi |
| hazard_note | Irritant/Keep Cold |
| Sicherheitshinweise (S) | 36/37 |
Anwendungen & Verwendung
Verwenden
4-Chloro-2-methoxyaniline is an important intermediate used for the synthesis of CXCR2 antagonists and some CD4-gp120 binding inhibitors.