5-[(4-chloro-2-nitrophenoxy)methyl]furan-2-carboxylic acid
Chemical Structure Depiction of
5-[(4-chloro-2-nitrophenoxy)methyl]furan-2-carboxylic acid
5-[(4-chloro-2-nitrophenoxy)methyl]furan-2-carboxylic acid
Compound characteristics
| Compound ID: | 6228-1787 |
| Compound Name: | 5-[(4-chloro-2-nitrophenoxy)methyl]furan-2-carboxylic acid |
| Molecular Weight: | 297.65 |
| Molecular Formula: | C12 H8 Cl N O6 |
| Smiles: | C(c1ccc(C(O)=O)o1)Oc1ccc(cc1[N+]([O-])=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.4946 |
| logD: | -1.4893 |
| logSw: | -2.7515 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.883 |
| InChI Key: | QEYBYUDBRCVEST-UHFFFAOYSA-N |