5-[(3-methyl-4-nitrophenoxy)methyl]furan-2-carboxylic acid
Chemical Structure Depiction of
5-[(3-methyl-4-nitrophenoxy)methyl]furan-2-carboxylic acid
5-[(3-methyl-4-nitrophenoxy)methyl]furan-2-carboxylic acid
Compound characteristics
| Compound ID: | Y503-2293 |
| Compound Name: | 5-[(3-methyl-4-nitrophenoxy)methyl]furan-2-carboxylic acid |
| Molecular Weight: | 277.23 |
| Molecular Formula: | C13 H11 N O6 |
| Smiles: | Cc1cc(ccc1[N+]([O-])=O)OCc1ccc(C(O)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 2.7322 |
| logD: | -1.2518 |
| logSw: | -2.8478 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.796 |
| InChI Key: | CEVRYRJNYZJMKC-UHFFFAOYSA-N |