HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
Benzenamine, 2,6-dimethoxy-
2,6-dimethoxybenzenamine · NSC 43758 · BUTTPARK 33\04-69 · 2,6-Dimethoxyaniline · 2,6-Dimethoxyaniline >2,6-Dimethoxyaniline 98% · 2,6-Dimethoxy-phenylamine · 2,6-Dimethoxyaniline ,98% · 2,6-Dimethoxyaniline, 97%
Identifikatoren & physikalische Daten
| CAS No. | 2734-70-5 |
|---|---|
| Summenformel | C8H11NO2 |
| Durchschnittliche Molmasse | 153,18 g/mol |
| Monoisotopische Masse | 153,07897859 g/mol |
| SMILES | COc1cccc(OC)c1N |
| InChIKey | HQBJSEKQNRSDAZ-UHFFFAOYSA-N |
| PubChem CID | 95940 |
| EC No. | 679-090-4 |
| DTXSID | DTXSID50181777 |
Chemische & physikalische Eigenschaften
| XLogP | 0,8 |
|---|---|
| Polarare Oberfläche (TPSA) | 44,5 |
| H-Brücken-Donoren | 1 |
| H-Brücken-Akzeptoren | 3 |
| Frei drehbare Bindungen | 2 |
| Schwere Atome | 11 |
| Formalladung | 0 |
| Komplexität | 107 |
| Schmelzpunkt | 71-74 |
| Siedepunkt | 254℃ |
| Dichte | 1.096 |
| Brechungsindex | 1.4770 (estimate) |
| Flammpunkt | 116℃ |
| Lagerbedingungen | Keep in dark place,Inert atmosphere,Room temperature |
| Aggregatzustand | powder to crystal |
| pKa (Säurekonstante) | 4.48±0.10(Predicted) |
| Farbe | White to Gray to Brown |
| Löslichkeit | Slightly soluble in water. |
| InChI | InChI=1S/C8H11NO2/c1-10-6-4-3-5-7(11-2)8(6)9/h3-5H,9H2,1-2H3 |
| InChIKey | HQBJSEKQNRSDAZ-UHFFFAOYSA-N |
| SMILES | C1(N)=C(OC)C=CC=C1OC |
| CAS Datenbank | 2734-70-5(CAS DataBase Reference) |
Sicherheit & Vorschriften
| GHS-Einstufung | DangerH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P260, P261, P262, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 8 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Hazard Classes and Categories | Acute Tox. 4 (100%) |
| TSCA-Inventar-Status | N |
| UN-Transportnummer | UN2811 |
| Zollcode | 29214200 |
| R-Sätze (R) | 20/21/22-36/37/38-36-33 |
| Gefahrensymbole | Xi,T |
| hazard_note | Toxic/Irritant |
| Sicherheitshinweise (S) | 26-36/37/39-36/37-28 |
| Gefahrenklasse | 6.1 |
| Verpackungsgruppe | III |
Anwendungen & Verwendung
Verwenden
2,6-Dimethylaniline degradation by Fenton process has been studied in depth for the purpose of learning more about the reactions involved in the oxidation of 2,6-dimethylaniline under various reaction conditions. Using a previously developed gas chromatographic-mass spectrometric assay, hemoglobin adducts of 2,6-dimethylaniline were detected covalently bound to rat hemoglobin after administration of either 2,6-dimethylaniline or lidocaine.