5-methoxy-2-[3-(4-methoxyphenyl)prop-2-enoyl]phenyl borodifluoridate
Chemical Structure Depiction of
5-methoxy-2-[3-(4-methoxyphenyl)prop-2-enoyl]phenyl borodifluoridate
5-methoxy-2-[3-(4-methoxyphenyl)prop-2-enoyl]phenyl borodifluoridate
Compound characteristics
| Compound ID: | 0579-0086 |
| Compound Name: | 5-methoxy-2-[3-(4-methoxyphenyl)prop-2-enoyl]phenyl borodifluoridate |
| Molecular Weight: | 332.11 |
| Molecular Formula: | C17 H15 B F2 O4 |
| Smiles: | [B](Oc1cc(ccc1C(/C=C/c1ccc(cc1)OC)=O)OC)(F)F |
| Stereo: | ACHIRAL |
| logP: | 3.623 |
| logD: | 3.623 |
| logSw: | -3.9505 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.989 |
| InChI Key: | NLDWAUUUMXWZHZ-UHFFFAOYSA-N |