129227-56-1
| Name | 1,3-Propanedione, 1-(4-bromophenyl)-3-(4-methylphenyl)- |
| CAS | 129227-56-1 |
| Molecular Formula | C16H13BrO2 |
| Molecular Weight | 317.18 |
| MOL File | 129227-56-1.mol |
Chemical Properties
| Melting point | 162-165 °C |
| Boiling point | 456.5±35.0 °C(Predicted) |
| density | 1.382±0.06 g/cm3(Predicted) |
| form | solid |
| pka | 8.93±0.13(Predicted) |
| InChI | 1S/C16H13BrO2/c1-11-2-4-12(5-3-11)15(18)10-16(19)13-6-8-14(17)9-7-13/h2-9H,10H2,1H3 |
| InChIKey | SRYRNQWVINEOOW-UHFFFAOYSA-N |
| SMILES | CC1=CC=C(C(CC(C2=CC=C(Br)C=C2)=O)=O)C=C1 |