3-(4-bromophenyl)-3-oxopropanenitrile
Chemical Structure Depiction of
3-(4-bromophenyl)-3-oxopropanenitrile
3-(4-bromophenyl)-3-oxopropanenitrile
Compound characteristics
| Compound ID: | C614-0246 |
| Compound Name: | 3-(4-bromophenyl)-3-oxopropanenitrile |
| Molecular Weight: | 224.05 |
| Molecular Formula: | C9 H6 Br N O |
| Smiles: | C(C#N)C(c1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 1.9113 |
| logD: | 0.2666 |
| logSw: | -2.1776 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 30.9771 |
| InChI Key: | HSNWUXWZCSDJPL-UHFFFAOYSA-N |