1-(beta-carboxyethyl)-3,3-dimethyl-6'-nitrospiro(indoline- 2,2'-2H-benzopyran)
- Product Name1-(beta-carboxyethyl)-3,3-dimethyl-6'-nitrospiro(indoline- 2,2'-2H-benzopyran)
- CAS55779-26-5
- MFC21H20N2O5
- MW380.39
- EINECS
- MOL File55779-26-5.mol
Chemical Properties
| Melting point | 199-200 °C |
| Boiling point | 588.7±50.0 °C(Predicted) |
| Density | 1.40±0.1 g/cm3(Predicted) |
| pka | 4.33±0.10(Predicted) |
| InChI | InChI=1S/C21H20N2O5/c1-20(2)16-5-3-4-6-17(16)22(12-10-19(24)25)21(20)11-9-14-13-15(23(26)27)7-8-18(14)28-21/h3-9,11,13H,10,12H2,1-2H3,(H,24,25) |
| InChIKey | MHCGTEBQHSVRDP-UHFFFAOYSA-N |
| SMILES | C12(C(C)(C)C3=C(N1CCC(O)=O)C=CC=C3)OC1=CC=C([N+]([O-])=O)C=C1C=C2 |