6-(4-chlorophenyl)-3,5,5-trimethyl-3-[2-(4-nitrophenyl)-2-oxoethyl]oxane-2,4-dione
					Chemical Structure Depiction of
6-(4-chlorophenyl)-3,5,5-trimethyl-3-[2-(4-nitrophenyl)-2-oxoethyl]oxane-2,4-dione
			6-(4-chlorophenyl)-3,5,5-trimethyl-3-[2-(4-nitrophenyl)-2-oxoethyl]oxane-2,4-dione
Compound characteristics
| Compound ID: | 4605-0224 | 
| Compound Name: | 6-(4-chlorophenyl)-3,5,5-trimethyl-3-[2-(4-nitrophenyl)-2-oxoethyl]oxane-2,4-dione | 
| Molecular Weight: | 429.86 | 
| Molecular Formula: | C22 H20 Cl N O6 | 
| Smiles: | CC1(C)C(c2ccc(cc2)[Cl])OC(C(C)(CC(c2ccc(cc2)[N+]([O-])=O)=O)C1=O)=O | 
| Stereo: | MIXTURE OF STEREOISOMERS | 
| logP: | 4.7997 | 
| logD: | 4.7997 | 
| logSw: | -5.2273 | 
| Hydrogen bond acceptors count: | 11 | 
| Polar surface area: | 81.182 | 
| InChI Key: | ZOZQZVVNBNVCGN-UHFFFAOYSA-N | 
 
				 
				