4-bromo-5-(nitromethyl)-3-phenoxyfuran-2(5H)-one
Chemical Structure Depiction of
4-bromo-5-(nitromethyl)-3-phenoxyfuran-2(5H)-one
4-bromo-5-(nitromethyl)-3-phenoxyfuran-2(5H)-one
Compound characteristics
| Compound ID: | 8006-3083 |
| Compound Name: | 4-bromo-5-(nitromethyl)-3-phenoxyfuran-2(5H)-one |
| Molecular Weight: | 314.09 |
| Molecular Formula: | C11 H8 Br N O5 |
| Smiles: | C(C1C(=C(C(=O)O1)Oc1ccccc1)[Br])[N+]([O-])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1069 |
| logD: | 2.0984 |
| logSw: | -2.381 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 67.272 |
| InChI Key: | PUHWWEDNPGAPRR-QMMMGPOBSA-N |