4-decylphenyl 2,4-dinitrobenzoate
Chemical Structure Depiction of
4-decylphenyl 2,4-dinitrobenzoate
4-decylphenyl 2,4-dinitrobenzoate
Compound characteristics
| Compound ID: | 0077-0042 |
| Compound Name: | 4-decylphenyl 2,4-dinitrobenzoate |
| Molecular Weight: | 428.48 |
| Molecular Formula: | C23 H28 N2 O6 |
| Smiles: | CCCCCCCCCCc1ccc(cc1)OC(c1ccc(cc1[N+]([O-])=O)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 8.1824 |
| logD: | 8.1824 |
| logSw: | -5.7651 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 87.078 |
| InChI Key: | HEXFYLXFSPRCPS-UHFFFAOYSA-N |