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9,10-Dihydroanthracen
Anthracene, dihydro- · 9,10-DIHYDROANTHRACENE · Trofinetide Impurity 20 · 6-Methoxy-1-Tetralone99% · 9,10-Dihydroanthracene>9,10-Dihydroanthracene,99% · 9,10-Dihydroanthracene,90%,tech. · 9,10-DIHYDROANTHRACENE, TECHN. 90% · 9,10-DIHYDROANTHRACENE OEKANAL
Identifikatoren & physikalische Daten
| CAS No. | 613-31-0 |
|---|---|
| Summenformel | C14H12 |
| Durchschnittliche Molmasse | 180,24 g/mol |
| Monoisotopische Masse | 180,09390038 g/mol |
| SMILES | c1ccc2c(c1)Cc1ccccc1C2 |
| InChIKey | WPDAVTSOEQEGMS-UHFFFAOYSA-N |
| PubChem CID | 11940 |
| ChEMBL | CHEMBL125337 |
| EC No. | 210-336-1 |
| DTXSID | DTXSID3075256 |
| Lokaler Name | 9,10-Dihydroanthracen |
Chemische & physikalische Eigenschaften
| XLogP | 4,2 |
|---|---|
| Polarare Oberfläche (TPSA) | 0 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 0 |
| Frei drehbare Bindungen | 0 |
| Schwere Atome | 14 |
| Formalladung | 0 |
| Komplexität | 154 |
| Polymers | Other Classes -> Polycyclic Aromatic Hydrocarbons |
| SpringerMaterials Properties | Boiling point |
| LogP (Verteilungskoeffizient) | 4.25 |
| Dampfdruck | 0.00129 [mmHg] |
| Physical Description | Solid[Sigma-Aldrich MSDS] |
| Schmelzpunkt | 103-107 °C (lit.) |
| Siedepunkt | 312 °C (lit.) |
| Dichte | 0.88 g/mL at 25 °C (lit.) |
| Brechungsindex | 1.6415 (estimate) |
| Lagerbedingungen | Sealed in dry,Room Temperature |
| Aggregatzustand | powder to crystal |
| Farbe | White to Almost white |
| Löslichkeit | 1.332mg/L(24.59 ºC) |
| BRN | 1364575 |
| Henry-Konstante | 1.5×10-1 mol/(m3Pa) at 25℃, Schröder et al. (2010) |
| Stabilität | Stable. Combustible. Incompatible with strong oxidizing agents. |
| InChI | InChI=1S/C14H12/c1-2-6-12-10-14-8-4-3-7-13(14)9-11(12)5-1/h1-8H,9-10H2 |
| InChIKey | WPDAVTSOEQEGMS-UHFFFAOYSA-N |
| SMILES | C1=C2C(CC3=C(C2)C=CC=C3)=CC=C1 |
| CAS Datenbank | 613-31-0(CAS DataBase Reference) |
| EPA chemische Informationen | Anthracene, 9,10-dihydro- (613-31-0) |
Sicherheit & Vorschriften
| GHS-Einstufung | WarningH400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]P273, P391, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 40 reports by companies from 2 notifications to the ECHA C&L Inventory. |
|---|---|
| Regulatorische Informationen | Chemical: Anthracene, 9,10-dihydro- |
| Gefahrenübersicht | May cause irritation[Sigma-Aldrich MSDS] See POLYCYCLIC AROMATIC HYDROCARBONS. |
| Hazard Classes and Categories | Aquatic Acute 1 (100%) |
| Wassergefährdungsklasse (WGK) | 3 |
| UN-Transportnummer | UN 3077 9 / PGIII |
| Zollcode | 2902.90.9000 |
| R-Sätze (R) | 36/37/38 |
| Gefahrensymbole | Xi |
| Sicherheitshinweise (S) | 22-24/25-36/37-26 |
| Gefahrenklasse | 9Aquatic Acute 1 |
| Verpackungsgruppe | III |
| Lagerklasse | 11 - Combustible Solids |
Anwendungen & Verwendung
Verwenden
9,10-Dihydroanthracene(DHA) has been used in a study to assess the hydrogen abstraction capability of valence-delocalized iron complex with DHA in MeCN.