Identifikatoren & physikalische Daten
| CAS No. | 20041-26-3 |
|---|
| Summenformel | C17H17NO |
|---|
| Durchschnittliche Molmasse | 251,32 g/mol |
|---|
| Monoisotopische Masse | 251,13101417 g/mol |
|---|
| SMILES | CCOc1ccc(N=CC=Cc2ccccc2)cc1 |
|---|
| InChIKey | BIPJQHNMXIQBES-UHFFFAOYSA-N |
|---|
| PubChem CID | 3549865 |
|---|
| EC No. | 667-564-3 |
|---|
| DTXSID | DTXSID30393553 |
|---|
Chemische & physikalische Eigenschaften
| XLogP | 4 |
|---|
| Polarare Oberfläche (TPSA) | 21,6 |
|---|
| H-Brücken-Donoren | 0 |
|---|
| H-Brücken-Akzeptoren | 2 |
|---|
| Frei drehbare Bindungen | 5 |
|---|
| Schwere Atome | 19 |
|---|
| Formalladung | 0 |
|---|
| Komplexität | 284 |
|---|
Sicherheit & Vorschriften
| GHS-Einstufung | WarningH317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]P261, P272, P280, P302+P352, P321, P333+P317, P362+P364, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. |
|---|
| Hazard Classes and Categories | Skin Sens. 1 (100%) |
|---|
