6-chloro-2,3-dimethyl-4-{[(4-nitrobenzoyl)oxy]imino}cyclohexa-2,5-dien-1-one
Chemical Structure Depiction of
6-chloro-2,3-dimethyl-4-{[(4-nitrobenzoyl)oxy]imino}cyclohexa-2,5-dien-1-one
6-chloro-2,3-dimethyl-4-{[(4-nitrobenzoyl)oxy]imino}cyclohexa-2,5-dien-1-one
Compound characteristics
| Compound ID: | 2548-0682 |
| Compound Name: | 6-chloro-2,3-dimethyl-4-{[(4-nitrobenzoyl)oxy]imino}cyclohexa-2,5-dien-1-one |
| Molecular Weight: | 334.71 |
| Molecular Formula: | C15 H11 Cl N2 O5 |
| Smiles: | CC1=C(C)C(C(=C/C1=N/OC(c1ccc(cc1)[N+]([O-])=O)=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.5988 |
| logD: | 3.5988 |
| logSw: | -3.9972 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 78.282 |
| InChI Key: | LTZFYIWQAMZGIU-UHFFFAOYSA-N |