2-methyl-3-[5-(2-nitroethenyl)furan-2-yl]benzoic acid
Chemical Structure Depiction of
2-methyl-3-[5-(2-nitroethenyl)furan-2-yl]benzoic acid
2-methyl-3-[5-(2-nitroethenyl)furan-2-yl]benzoic acid
Compound characteristics
| Compound ID: | 5446-1961 |
| Compound Name: | 2-methyl-3-[5-(2-nitroethenyl)furan-2-yl]benzoic acid |
| Molecular Weight: | 273.24 |
| Molecular Formula: | C14 H11 N O5 |
| Smiles: | Cc1c(cccc1c1ccc(/C=C/[N+]([O-])=O)o1)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2387 |
| logD: | -0.251 |
| logSw: | -3.3589 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.476 |
| InChI Key: | MIPDUMZIFSBEMO-UHFFFAOYSA-N |