1.0 2026-09-22 03:56:40 UTC 2026-09-22 03:56:40 UTC FDB117659 4-(4-Nitrobenzyl)pyridine 4-[(4-nitrophenyl)methyl]pyridine C12H10N2O2 214.22 214.074227574 4-[(4-nitrophenyl)methyl]pyridine 4-[(4-nitrophenyl)methyl]pyridine O=N(=O)C1=CC=C(CC2=CC=NC=C2)C=C1 InChI=1S/C12H10N2O2/c15-14(16)12-3-1-10(2-4-12)9-11-5-7-13-8-6-11/h1-8H,9H2 MNHKUCBXXMFQDM-UHFFFAOYSA-N belongs to the class of organic compounds known as nitrobenzenes. Nitrobenzenes are compounds containing a nitrobenzene moiety, which consists of a benzene ring with a carbon bearing a nitro group. Nitrobenzenes Organic compounds Benzenoids Benzene and substituted derivatives Nitrobenzenes Aromatic heteromonocyclic compounds Azacyclic compounds Heteroaromatic compounds Hydrocarbon derivatives Nitroaromatic compounds Organic oxides Organic oxoazanium compounds Organonitrogen compounds Organopnictogen compounds Propargyl-type 1,3-dipolar organic compounds Pyridines and derivatives Allyl-type 1,3-dipolar organic compound Aromatic heteromonocyclic compound Azacycle C-nitro compound Heteroaromatic compound Hydrocarbon derivative Nitroaromatic compound Nitrobenzene Organic 1,3-dipolar compound Organic nitro compound Organic nitrogen compound Organic oxide Organic oxoazanium Organic oxygen compound Organoheterocyclic compound Organonitrogen compound Organopnictogen compound Propargyl-type 1,3-dipolar organic compound Pyridine logp 2.74 ALOGPS logs -2.91 ALOGPS solubility 2.66e-01 g/l ALOGPS logp 2.79 ChemAxon pka_strongest_basic 5.31 ChemAxon iupac 4-[(4-nitrophenyl)methyl]pyridine ChemAxon average_mass 214.22 ChemAxon mono_mass 214.074227574 ChemAxon smiles O=N(=O)C1=CC=C(CC2=CC=NC=C2)C=C1 ChemAxon formula C12H10N2O2 ChemAxon inchi InChI=1S/C12H10N2O2/c15-14(16)12-3-1-10(2-4-12)9-11-5-7-13-8-6-11/h1-8H,9H2 ChemAxon inchikey MNHKUCBXXMFQDM-UHFFFAOYSA-N ChemAxon polar_surface_area 58.71 ChemAxon refractivity 60.96 ChemAxon polarizability 21.25 ChemAxon rotatable_bond_count 3 ChemAxon acceptor_count 3 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 104780 Specdb::CMs 116796 Specdb::MsMs 99621 Specdb::MsMs 99622 Specdb::MsMs 99623 Specdb::MsMs 164790 Specdb::MsMs 164791 Specdb::MsMs 164792