N-[2-(4-tert-butylphenoxy)ethyl]-5-chloro-2-nitroaniline
Chemical Structure Depiction of
N-[2-(4-tert-butylphenoxy)ethyl]-5-chloro-2-nitroaniline
N-[2-(4-tert-butylphenoxy)ethyl]-5-chloro-2-nitroaniline
Compound characteristics
| Compound ID: | 8007-2193 |
| Compound Name: | N-[2-(4-tert-butylphenoxy)ethyl]-5-chloro-2-nitroaniline |
| Molecular Weight: | 348.83 |
| Molecular Formula: | C18 H21 Cl N2 O3 |
| Smiles: | CC(C)(C)c1ccc(cc1)OCCNc1cc(ccc1[N+]([O-])=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 6.3538 |
| logD: | 6.3538 |
| logSw: | -6.3752 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.115 |
| InChI Key: | XNZWOJBHWRUGFZ-UHFFFAOYSA-N |