N-(1-hydroxybutan-2-yl)-3-nitrobenzamide
Chemical Structure Depiction of
N-(1-hydroxybutan-2-yl)-3-nitrobenzamide
N-(1-hydroxybutan-2-yl)-3-nitrobenzamide
Compound characteristics
Compound ID: | Y031-7699 |
Compound Name: | N-(1-hydroxybutan-2-yl)-3-nitrobenzamide |
Molecular Weight: | 238.24 |
Molecular Formula: | C11 H14 N2 O4 |
Smiles: | CCC(CO)NC(c1cccc(c1)[N+]([O-])=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 1.5642 |
logD: | 1.5642 |
logSw: | -2.1769 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 75.329 |
InChI Key: | YYGDFKGDBDHNSF-VIFPVBQESA-N |