HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
3-Nitrofluoren-9-on
NSC 9080 · 3-nitrofluorenone · 3-nitrofluoren-9-one · 3-Nitro-9H-fluoren-9-one · 9H-Fluoren-9-one, 3-nitro-
Identifikatoren & physikalische Daten
| CAS No. | 42135-22-8 |
|---|---|
| Summenformel | C13H7NO3 |
| Durchschnittliche Molmasse | 225,2 g/mol |
| Monoisotopische Masse | 225,04259309 g/mol |
| SMILES | O=C1c2ccccc2-c2cc([N+](=O)[O-])ccc21 |
| InChIKey | GLVSVKSIYXDZHY-UHFFFAOYSA-N |
| PubChem CID | 39141 |
| ChEMBL | CHEMBL354533 |
| EC No. | 255-675-6 |
| DTXSID | DTXSID9075325 |
| Lokaler Name | 3-Nitrofluoren-9-on |
Chemische & physikalische Eigenschaften
| XLogP | 3,1 |
|---|---|
| Polarare Oberfläche (TPSA) | 62,9 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 3 |
| Frei drehbare Bindungen | 0 |
| Schwere Atome | 17 |
| Formalladung | 0 |
| Komplexität | 349 |
| Polymers | Other Classes -> Polycyclic Aromatic Hydrocarbons |
| SpringerMaterials Properties | Chemical shift |
| LogP (Verteilungskoeffizient) | 3.06 |
| Schmelzpunkt | 430 to 437 °F (NTP, 1992)239.5°C |
| Dampfdruck | 0.00000089 [mmHg] |
| Physical Description | 3-nitro-9-fluorenone is a solid. (NTP, 1992)[CAMEO] |
| Siedepunkt | 366.7°C (rough estimate) |
| Dichte | 1.2785 (rough estimate) |
| Brechungsindex | 1.4800 (estimate) |
| EPA chemische Informationen | 3-Nitro-9-fluorenone (42135-22-8) |
Sicherheit & Vorschriften
| Brandgefahren | Flash point data for this chemical are not available. It is probably combustible. (NTP, 1992) |
|---|---|
| Gesundheitsgefahren | ACUTE/CHRONIC HAZARDS: When heated to decomposition this compound emits toxic fumes. (NTP, 1992) |
| Gefahrenübersicht | See Fluorene and Fluorenone. |
| Reaktive Gruppe | Ketones |
| Reactivity Profile | A nitrated ketone. Ketones are reactive with many acids and bases liberating heat and flammable gases (e.g., H2). The amount of heat may be sufficient to start a fire in the unreacted portion of the ketone. Ketones react with reducing agents such as hydrides, alkali metals, and nitrides to produce flammable gas (H2) and heat. Ketones are incompatible with isocyanates, aldehydes, cyanides, peroxides, and anhydrides. They react violently with aldehydes, HNO3, HNO3 + H2O2, and HClO4. |
| Air and Water Reactions | No rapid reaction with air. No rapid reaction with water. |
| Brandbekämpfung | Fires involving this material can be controlled with a dry chemical, carbon dioxide or Halon extinguisher. (NTP, 1992) |
| Erste Hilfe | EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop. |
| Freisetung ohne Brand | SMALL SPILLS AND LEAKAGE: If you spill this chemical, FIRST REMOVE ALL SOURCES OF IGNITION, then dampen the solid spill material with toluene, then transfer the dampened material to a suitable container. Use absorbent paper dampened with toluene to pick up any remaining material. Your contaminated clothing and absorbent paper should be sealed in a vapor-tight plastic bag for eventual disposal. Solvent-wash all contaminated surfaces with toluene followed by washing with a soap and water solution. Do not reenter the contaminated area until the Safety Officer (or other responsible person) has verified that the area has been properly cleaned. |
| Personal Protective Equipment (PPE) |
Anwendungen & Verwendung
Verwenden
3-Nitrofluorenone is a nitrated polycyclic aromatic hydrocarbon (PAH) with mutagenic activity.