3-acetamido-3-(4-nitrophenyl)propanoic acid
Chemical Structure Depiction of
3-acetamido-3-(4-nitrophenyl)propanoic acid
3-acetamido-3-(4-nitrophenyl)propanoic acid
Compound characteristics
Compound ID: | 8015-2127 |
Compound Name: | 3-acetamido-3-(4-nitrophenyl)propanoic acid |
Molecular Weight: | 252.22 |
Molecular Formula: | C11 H12 N2 O5 |
Smiles: | CC(NC(CC(O)=O)c1ccc(cc1)[N+]([O-])=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 0.586 |
logD: | -2.0517 |
logSw: | -1.8421 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 86.218 |
InChI Key: | IGXJPNSMMOYCOC-JTQLQIEISA-N |