HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
Diphenylphosphinamide
P,P-Diphenylphosphinic amide · AURORA KA-1558 · DIPHENYLPHOSPHINAMIDE · Diphenylphosphinamide,98% · Phosphinic amide, P,P-diphenyl- · [amino(phenyl)phosphoryl]benzene · Diphenyl phosphinic acid amide · [Amino(phenyl)phosphoroso]benzene
Identifikatoren & physikalische Daten
| CAS No. | 5994-87-6 |
|---|---|
| Summenformel | C12H12NOP |
| Durchschnittliche Molmasse | 217,2 g/mol |
| Monoisotopische Masse | 217,065651 g/mol |
| SMILES | NP(=O)(c1ccccc1)c1ccccc1 |
| InChIKey | RIGIWEGXTTUCIQ-UHFFFAOYSA-N |
| PubChem CID | 853560 |
| EC No. | 626-207-1 |
| DTXSID | DTXSID40357449 |
Chemische & physikalische Eigenschaften
| XLogP | 0,5 |
|---|---|
| Polarare Oberfläche (TPSA) | 43,1 |
| H-Brücken-Donoren | 1 |
| H-Brücken-Akzeptoren | 2 |
| Frei drehbare Bindungen | 2 |
| Schwere Atome | 15 |
| Formalladung | 0 |
| Komplexität | 220 |
| Schmelzpunkt | 160-162°C |
| Siedepunkt | 368.1±25.0 °C(Predicted) |
| Dichte | 1.20±0.1 g/cm3(Predicted) |
| Lagerbedingungen | Keep in dark place,Inert atmosphere,Room temperature |
| Löslichkeit | Soluble in chloroform, nitromethane, nitrobenzene. |
| Aggregatzustand | solid |
| pKa (Säurekonstante) | 1.56±0.70(Predicted) |
| InChI | InChI=1S/C12H12NOP/c13-15(14,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H,(H2,13,14) |
| InChIKey | RIGIWEGXTTUCIQ-UHFFFAOYSA-N |
| SMILES | P(C1=CC=CC=C1)(C1=CC=CC=C1)(N)=O |
Sicherheit & Vorschriften
| GHS-Einstufung | WarningH302 (90.7%): Harmful if swallowed [Warning Acute toxicity, oral]P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 43 reports by companies from 2 notifications to the ECHA C&L Inventory.Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website. |
|---|---|
| Hazard Classes and Categories | Acute Tox. 4 (90.7%) |
| Wassergefährdungsklasse (WGK) | 3 |
| R-Sätze (R) | 36/37/38-22 |
| Gefahrensymbole | Xn |
| Sicherheitshinweise (S) | 26-37/39 |
| Lagerklasse | 11 - Combustible Solids |
| Gefahrenklasse | Acute Tox. 4 Oral |
Anwendungen & Verwendung
Verwenden
Diphenylphosphinamide is used to furnish 5H-oxazol-4-ones with diastereoselectivity and enantioselectivity.