methyl 3-[(3-methylbutyl)carbamoyl]-5-nitrobenzoate
					Chemical Structure Depiction of
methyl 3-[(3-methylbutyl)carbamoyl]-5-nitrobenzoate
			methyl 3-[(3-methylbutyl)carbamoyl]-5-nitrobenzoate
Compound characteristics
| Compound ID: | Y032-0803 | 
| Compound Name: | methyl 3-[(3-methylbutyl)carbamoyl]-5-nitrobenzoate | 
| Molecular Weight: | 294.3 | 
| Molecular Formula: | C14 H18 N2 O5 | 
| Smiles: | CC(C)CCNC(c1cc(cc(c1)[N+]([O-])=O)C(=O)OC)=O | 
| Stereo: | ACHIRAL | 
| logP: | 2.8295 | 
| logD: | 2.8294 | 
| logSw: | -3.3325 | 
| Hydrogen bond acceptors count: | 9 | 
| Hydrogen bond donors count: | 1 | 
| Polar surface area: | 79.32 | 
| InChI Key: | HHIGOCXMKUNLQG-UHFFFAOYSA-N | 
 
				 
				