3-chloro-6-hydroxy-2,4-dimethyl-5-nitrobenzaldehyde
Chemical Structure Depiction of
3-chloro-6-hydroxy-2,4-dimethyl-5-nitrobenzaldehyde
3-chloro-6-hydroxy-2,4-dimethyl-5-nitrobenzaldehyde
Compound characteristics
| Compound ID: | 0781-2501 |
| Compound Name: | 3-chloro-6-hydroxy-2,4-dimethyl-5-nitrobenzaldehyde |
| Molecular Weight: | 229.62 |
| Molecular Formula: | C9 H8 Cl N O4 |
| Smiles: | [H]C(c1c(C)c(c(C)c(c1O)[N+]([O-])=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.854 |
| logD: | 1.7513 |
| logSw: | -3.2944 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.657 |
| InChI Key: | QVMMXFNTUWSWHN-UHFFFAOYSA-N |