ethyl 1-oxo-2-{3-[(propan-2-yl)oxy]propyl}-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylate
Chemical Structure Depiction of
ethyl 1-oxo-2-{3-[(propan-2-yl)oxy]propyl}-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylate
ethyl 1-oxo-2-{3-[(propan-2-yl)oxy]propyl}-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylate
Compound characteristics
| Compound ID: | 8016-4649 |
| Compound Name: | ethyl 1-oxo-2-{3-[(propan-2-yl)oxy]propyl}-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylate |
| Molecular Weight: | 323.39 |
| Molecular Formula: | C17 H25 N O5 |
| Smiles: | CCOC(C1C2C(N(CCCOC(C)C)CC23C=CC1O3)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.395 |
| logD: | 1.395 |
| logSw: | -1.2523 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.752 |
| InChI Key: | CPXMIERIFISBPP-UHFFFAOYSA-N |