6,8-dichloro-2-(3,4-diethoxyphenyl)-3-nitro-2H-1-benzopyran
Chemical Structure Depiction of
6,8-dichloro-2-(3,4-diethoxyphenyl)-3-nitro-2H-1-benzopyran
6,8-dichloro-2-(3,4-diethoxyphenyl)-3-nitro-2H-1-benzopyran
Compound characteristics
| Compound ID: | 8012-5513 |
| Compound Name: | 6,8-dichloro-2-(3,4-diethoxyphenyl)-3-nitro-2H-1-benzopyran |
| Molecular Weight: | 410.25 |
| Molecular Formula: | C19 H17 Cl2 N O5 |
| Smiles: | CCOc1ccc(cc1OCC)C1C(=Cc2cc(cc(c2O1)[Cl])[Cl])[N+]([O-])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.294 |
| logD: | 5.294 |
| logSw: | -6.151 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.784 |
| InChI Key: | MIFCNUVHGHFFFY-IBGZPJMESA-N |