177093-58-2
| Name | 3-[4-(BROMOMETHYL)PHENYL]-7-(DIETHYLAMIN |
| CAS | 177093-58-2 |
| Molecular Formula | C20H20BrNO2 |
| MDL Number | MFCD07784444 |
| Molecular Weight | 386.28 |
| MOL File | 177093-58-2.mol |
Chemical Properties
| Melting point | 150-155 °C |
| Boiling point | 540.5±50.0 °C(Predicted) |
| density | 1.380±0.06 g/cm3(Predicted) |
| storage temp. | 2-8°C |
| pka | 3.22±0.20(Predicted) |
| InChI | 1S/C20H20BrNO2/c1-3-22(4-2)17-10-9-16-11-18(20(23)24-19(16)12-17)15-7-5-14(13-21)6-8-15/h5-12H,3-4,13H2,1-2H3 |
| InChIKey | WTCCANMBFQWZMY-UHFFFAOYSA-N |
| SMILES | CCN(CC)c1ccc2C=C(C(=O)Oc2c1)c3ccc(CBr)cc3 |
Safety Data
| Hazard Codes | Xn |
| Risk Statements | |
| WGK Germany | 3 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Acute Tox. 4 Oral Aquatic Chronic 4 |