50526-21-1
| Name | 5-methoxy-3-(2-nitro-cis-propenyl)-indole |
| CAS | 50526-21-1 |
| Molecular Formula | C12H12N2O3 |
| Molecular Weight | 232.24 |
| MOL File | 50526-21-1.mol |
Chemical Properties
| Boiling point | 435.883±30.00 °C(Press: 760.00 Torr)(predicted) |
| density | 1.294±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted) |
| pka | 15.497±0.30(predicted) |
| InChI | InChI=1S/C12H12N2O3/c1-8(14(15)16)5-9-7-13-12-4-3-10(17-2)6-11(9)12/h3-7,13H,1-2H3 |
| InChIKey | NOHVRMCHFYSQID-UHFFFAOYSA-N |
| SMILES | N1C2=C(C=C(OC)C=C2)C(C=C([N+]([O-])=O)C)=C1 |