3-amino-4,4,4-trichloro-1-(4-nitrophenyl)butan-1-one
Chemical Structure Depiction of
3-amino-4,4,4-trichloro-1-(4-nitrophenyl)butan-1-one
3-amino-4,4,4-trichloro-1-(4-nitrophenyl)butan-1-one
Compound characteristics
| Compound ID: | 0329-0191 |
| Compound Name: | 3-amino-4,4,4-trichloro-1-(4-nitrophenyl)butan-1-one |
| Molecular Weight: | 311.55 |
| Molecular Formula: | C10 H9 Cl3 N2 O3 |
| Smiles: | C(C(C([Cl])([Cl])[Cl])N)C(c1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.6449 |
| logD: | 1.6449 |
| logSw: | -2.5076 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.656 |
| InChI Key: | CTBPJQRKQDPECC-VIFPVBQESA-N |