429689-17-8
| Name | (S)-METHYL-3-(1-METHYL-1H-INDOL-3-YL)-PHENYL-PROPIONATE |
| CAS | 429689-17-8 |
| Molecular Formula | C19H19NO2 |
| MDL Number | MFCD05664284 |
| Molecular Weight | 293.36 |
| MOL File | 429689-17-8.mol |
Chemical Properties
| Melting point | 89-93 °C (lit.) |
| Boiling point | 442.9±30.0 °C(Predicted) |
| density | 1.10±0.1 g/cm3(Predicted) |
| form | solid |
| Optical Rotation | [α]20/D +36°, c = 1% in chloroform |
| InChI | 1S/C19H19NO2/c1-20-13-17(15-10-6-7-11-18(15)20)16(12-19(21)22-2)14-8-4-3-5-9-14/h3-11,13,16H,12H2,1-2H3/t16-/m0/s1 |
| InChIKey | NFIUVSIKIXOXQK-INIZCTEOSA-N |
| SMILES | COC(=O)C[C@@H](c1ccccc1)c2cn(C)c3ccccc23 |
Safety Data
| Hazard Codes | Xn |
| Risk Statements | |
| Safety Statements | |
| WGK Germany | 3 |
| HS Code | 2933990099 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Eye Irrit. 2 Skin Sens. 1 |