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1,4-Bis[(2-methylphenyl)amino]anthrachinon
Blue E · C.I. 615670 · solvent blue 101 · C.I.Solvent Blue 101 · Solvent Blue 101,100% · C.I.Solvent Blue 101:C.I.615670 · Solvent Blue 101 (Technical Grade) · 1,4-Bis[(2-methylphenyl)amino]anthraquinone
![Molekülstruktur von 1,4-Bis[(2-methylphenyl)amino]anthrachinon](/img/chemical/62618.png)
Identifikatoren & physikalische Daten
| CAS No. | 6737-68-4 |
|---|---|
| Summenformel | C28H22N2O2 |
| Durchschnittliche Molmasse | 418,5 g/mol |
| Monoisotopische Masse | 418,16812794 g/mol |
| SMILES | Cc1ccccc1Nc1ccc(Nc2ccccc2C)c2c1C(=O)c1ccccc1C2=O |
| InChIKey | OLJXWJUQRAOAMD-UHFFFAOYSA-N |
| PubChem CID | 62618 |
| EC No. | 229-792-8 |
| DTXSID | DTXSID9052349 |
| Lokaler Name | 1,4-Bis[(2-methylphenyl)amino]anthrachinon |
Chemische & physikalische Eigenschaften
| XLogP | 7,8 |
|---|---|
| Polarare Oberfläche (TPSA) | 58,2 |
| H-Brücken-Donoren | 2 |
| H-Brücken-Akzeptoren | 4 |
| Frei drehbare Bindungen | 4 |
| Schwere Atome | 32 |
| Formalladung | 0 |
| Komplexität | 635 |
| Lebensmittelzusatzstoffe | Devices -> FDA Regulatory Status of Color Additives |
| Schmelzpunkt | 220.5-221.0 °C |
| Siedepunkt | 612.0±55.0 °C(Predicted) |
| Dichte | 1.292 |
| Dampfdruck | 0Pa at 25℃ |
| pKa (Säurekonstante) | -0.66±0.20(Predicted) |
| Löslichkeit | 6.97ng/L at 25℃ |
| LogP (Verteilungskoeffizient) | 8.69 at 25℃ |
| EPA chemische Informationen | 1,4-Bis(2-methylanilino)anthraquinone (6737-68-4) |
Sicherheit & Vorschriften
| GHS-Einstufung | This chemical does not meet GHS hazard criteria for 100% (52 of 52) of all reports.Not ClassifiedAggregated GHS information provided per 52 reports by companies from 1 notifications to the ECHA C&L Inventory. |
|---|---|
| Regulatorische Informationen | Chemical: 9,10-Anthracenedione, 1,4-bis[(2-methylphenyl)amino]-REACH registered substance: 1,4-bis[(2-methylphenyl)amino]anthraquinone (EC: 229-792-8)9,10-Anthracenedione, 1,4-bis(2-methylphenyl)amino-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right. |
| Hazard Classes and Categories | Not Classified |
| TSCA-Inventar-Status | TSCA listed |
Anwendungen & Verwendung
Verwenden
Solvent Blue 101 (Technical Grade) can be used for volatile dye and recording method.
Herstellung & Synthese
synthetische
1,4-Dihydroxyanthracene-9,10-dione and O-Methylaniline (2 Moore) condensation.