Identifikatoren & physikalische Daten
| CAS No. | 3782-80-7 |
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| Summenformel | C22H19NO2 |
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| Durchschnittliche Molmasse | 329,4 g/mol |
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| Monoisotopische Masse | 329,14157885 g/mol |
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| SMILES | CCOC(=O)c1ccc(N=Cc2ccc(-c3ccccc3)cc2)cc1 |
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| InChIKey | XCBIEOXLPPQJNF-UHFFFAOYSA-N |
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| PubChem CID | 19608 |
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| DTXSID | DTXSID8074861 |
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Chemische & physikalische Eigenschaften
| XLogP | 5,1 |
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| Polarare Oberfläche (TPSA) | 38,7 |
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| H-Brücken-Donoren | 0 |
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| H-Brücken-Akzeptoren | 3 |
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| Frei drehbare Bindungen | 6 |
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| Schwere Atome | 25 |
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| Formalladung | 0 |
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| Komplexität | 425 |
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Sicherheit & Vorschriften
| Brandgefahren | Flash point data for this chemical are not available. It is probably combustible. (NTP, 1992) |
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| Reaktive Gruppe | Amines, Phosphines, and Pyridines |
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| Reactivity Profile | Amines are chemical bases. They neutralize acids to form salts plus water. These acid-base reactions are exothermic. The amount of heat that is evolved per mole of amine in a neutralization is largely independent of the strength of the amine as a base. Amines may be incompatible with isocyanates, halogenated organics, peroxides, phenols (acidic), epoxides, anhydrides, and acid halides. Flammable gaseous hydrogen is generated by amines in combination with strong reducing agents, such as hydrides. |
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| Air and Water Reactions | No rapid reaction with air. No rapid reaction with water. |
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| Brandbekämpfung | Fires involving this material can be controlled with a dry chemical, carbon dioxide or Halon extinguisher. (NTP, 1992) |
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| 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. |
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| Freisetung ohne Brand | STORAGE PRECAUTIONS: You should store this material in a refrigerator. (NTP, 1992) |
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| Personal Protective Equipment (PPE) | RECOMMENDED RESPIRATOR: Where the neat test chemical is weighed and diluted, wear a NIOSH-approved half face respirator equipped with an organic vapor/acid gas cartridge (specific for organic vapors, HCl, acid gas and SO2) with a dust/mist filter. (NTP, 1992) |
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