3-methylphenyl 4-nitrobenzoate
Chemical Structure Depiction of
3-methylphenyl 4-nitrobenzoate
3-methylphenyl 4-nitrobenzoate
Compound characteristics
Compound ID: | 0868-0364 |
Compound Name: | 3-methylphenyl 4-nitrobenzoate |
Molecular Weight: | 257.24 |
Molecular Formula: | C14 H11 N O4 |
Smiles: | Cc1cccc(c1)OC(c1ccc(cc1)[N+]([O-])=O)=O |
Stereo: | ACHIRAL |
logP: | 3.6202 |
logD: | 3.6202 |
logSw: | -3.8995 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 53.998 |
InChI Key: | WIBCITOJDNRTAD-UHFFFAOYSA-N |