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1-(Methylamino)-4-[(3-methylphenyl)amino]anthrachinon
olvent blue 63 · Ceres Blue GN. · Solvent Blue 63 · SOLVENT BLUE GN · Solvent Blue BO · C.I.SOLVENTBLUE63 · Anthraquinone cyan · Transparent Blue GN
![Molekülstruktur von 1-(Methylamino)-4-[(3-methylphenyl)amino]anthrachinon](/img/chemical/80834.png)
Identifikatoren & physikalische Daten
| CAS No. | 6408-50-0 |
|---|---|
| Summenformel | C22H18N2O2 |
| Durchschnittliche Molmasse | 342,4 g/mol |
| Monoisotopische Masse | 342,13682782 g/mol |
| SMILES | CNc1ccc(Nc2cccc(C)c2)c2c1C(=O)c1ccccc1C2=O |
| InChIKey | GBAJQXFGDKEDBM-UHFFFAOYSA-N |
| PubChem CID | 80834 |
| EC No. | 229-059-2 |
| DTXSID | DTXSID7064318 |
| Lokaler Name | 1-(Methylamino)-4-[(3-methylphenyl)amino]anthrachinon |
Chemische & physikalische Eigenschaften
| XLogP | 5,9 |
|---|---|
| Polarare Oberfläche (TPSA) | 58,2 |
| H-Brücken-Donoren | 2 |
| H-Brücken-Akzeptoren | 4 |
| Frei drehbare Bindungen | 3 |
| Schwere Atome | 26 |
| Formalladung | 0 |
| Komplexität | 548 |
| Duftstoffe | Fragrance Ingredient (1-(Methylamino)-4-(m-tolylamino)-9,10-anthraquinone) -> IFRA transparency List |
| Siedepunkt | 566.4±50.0 °C(Predicted) |
| Dichte | 1.312±0.06 g/cm3(Predicted) |
| Dampfdruck | 0.002Pa at 25℃ |
| Löslichkeit | Chloroform (Slightly), DMSO (Slightly, Sonicated) |
| Aggregatzustand | Solid:particulate/powder |
| pKa (Säurekonstante) | 4.25±0.20(Predicted) |
| LogP (Verteilungskoeffizient) | 6.5 |
| EPA chemische Informationen | 9,10-Anthracenedione, 1-(methylamino)-4-[(3-methylphenyl)amino]- (6408-50-0) |
Sicherheit & Vorschriften
| GHS-Einstufung | This chemical does not meet GHS hazard criteria for 75% (15 of 20) of all reports.WarningH315 (10%): Causes skin irritation [Warning Skin corrosion/irritation]P261, P264, P264+P265, P271, P272, P273, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P333+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 20 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Regulatorische Informationen | Chemical: 9,10-Anthracenedione, 1-(methylamino)-4-[(3-methylphenyl)amino]-Hazard Traits - BioaccumulationEnvironmental PersistenceREACH registered substance: 1-(methylamino)-4-[(3-methylphenyl)amino]anthraquinone (EC: 229-059-2) |
| Hazard Classes and Categories | Skin Irrit. 2 (10%) |
| TSCA-Inventar-Status | TSCA listed |
Herstellung & Synthese
synthetische
1-Bromo-4-(methylamino)anthracene-9,10-dione and m-Toluidine reaction.