78469-86-0
| Name | (2R,3S)-(+)-3-(BENZYLOXYMETHYL)OXIRANE-2-METHANOL 4-NITROBENZOIC ACID ESTER |
| CAS | 78469-86-0 |
| Molecular Formula | C18H17NO6 |
| MDL Number | MFCD00043126 |
| Molecular Weight | 343.33 |
| MOL File | 78469-86-0.mol |
Chemical Properties
| Melting point | 78-80 °C |
| Boiling point | 509.5±35.0 °C(Predicted) |
| density | 1.299±0.06 g/cm3(Predicted) |
| form | solid |
| Optical Rotation | [α]20/D +34±1°, c =0.5% in chloroform |
| InChI | 1S/C18H17NO6/c20-18(14-6-8-15(9-7-14)19(21)22)24-12-17-16(25-17)11-23-10-13-4-2-1-3-5-13/h1-9,16-17H,10-12H2/t16-,17+/m0/s1 |
| InChIKey | XBAOYRZETQXAAE-DLBZAZTESA-N |
| SMILES | [O-][N+](=O)c1ccc(cc1)C(=O)OC[C@H]2O[C@H]2COCc3ccccc3 |
| CAS DataBase Reference | 78469-86-0 |