pentyl 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
pentyl 1-oxo-2-{3-[(propan-2-yl)oxy]propyl}-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylate
pentyl 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: | 8016-4650 |
| Compound Name: | pentyl 1-oxo-2-{3-[(propan-2-yl)oxy]propyl}-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylate |
| Molecular Weight: | 365.47 |
| Molecular Formula: | C20 H31 N O5 |
| Smiles: | CCCCCOC(C1C2C(N(CCCOC(C)C)CC23C=CC1O3)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.9951 |
| logD: | 2.9951 |
| logSw: | -2.8882 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.046 |
| InChI Key: | RFMPETSDZRKPCC-UHFFFAOYSA-N |