4-(pentyloxy)phenyl 2,4-dinitrobenzoate
Chemical Structure Depiction of
4-(pentyloxy)phenyl 2,4-dinitrobenzoate
4-(pentyloxy)phenyl 2,4-dinitrobenzoate
Compound characteristics
| Compound ID: | 0258-0095 |
| Compound Name: | 4-(pentyloxy)phenyl 2,4-dinitrobenzoate |
| Molecular Weight: | 374.35 |
| Molecular Formula: | C18 H18 N2 O7 |
| Smiles: | CCCCCOc1ccc(cc1)OC(c1ccc(cc1[N+]([O-])=O)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1616 |
| logD: | 5.1616 |
| logSw: | -4.9907 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 94.496 |
| InChI Key: | IQUXVWCCYFCTNM-UHFFFAOYSA-N |