1.0 2010-04-08 22:15:07 UTC 2019-11-26 03:19:10 UTC FDB020584 N-(2,5-Dihydroxyphenyl)pyridinium(1+) Isolated from the leaves of Punica granatum (pomegranate). N-(2,5-Dihydroxyphenyl)pyridinium(1+) is found in fruits. C11H10NO2 188.2026 188.071153569 1-(2,5-dihydroxyphenyl)-1λ⁵-pyridin-1-ylium 1-(2,5-dihydroxyphenyl)-1λ⁵-pyridin-1-ylium 33354-74-4 OC1=CC(=C(O)C=C1)[N+]1=CC=CC=C1 InChI=1S/C11H9NO2/c13-9-4-5-11(14)10(8-9)12-6-2-1-3-7-12/h1-8H,(H-,13,14)/p+1 BYQQTWROSPBRIU-UHFFFAOYSA-O belongs to the class of organic compounds known as hydroquinones. Hydroquinones are compounds containing a hydroquinone moiety, which consists of a benzene ring with a hydroxyl groups at positions 1 and 4. Hydroquinones Organic compounds Benzenoids Phenols Benzenediols Aromatic heteromonocyclic compounds 1-hydroxy-2-unsubstituted benzenoids Azacyclic compounds Benzene and substituted derivatives Heteroaromatic compounds Hydrocarbon derivatives Organic cations Organonitrogen compounds Organooxygen compounds Organopnictogen compounds Pyridinium derivatives 1-hydroxy-2-unsubstituted benzenoid Aromatic heteromonocyclic compound Azacycle Heteroaromatic compound Hydrocarbon derivative Hydroquinone Monocyclic benzene moiety Organic cation Organic nitrogen compound Organic oxygen compound Organoheterocyclic compound Organonitrogen compound Organooxygen compound Organopnictogen compound Pyridine Pyridinium logp -0.78 ALOGPS logs -3.05 ALOGPS solubility 2.00e-01 g/l ALOGPS logp -0.76 ChemAxon pka_strongest_acidic 6.7 ChemAxon pka_strongest_basic -6 ChemAxon iupac 1-(2,5-dihydroxyphenyl)-1λ⁵-pyridin-1-ylium ChemAxon average_mass 188.2026 ChemAxon mono_mass 188.071153569 ChemAxon smiles OC1=CC(=C(O)C=C1)[N+]1=CC=CC=C1 ChemAxon formula C11H10NO2 ChemAxon inchi InChI=1S/C11H9NO2/c13-9-4-5-11(14)10(8-9)12-6-2-1-3-7-12/h1-8H,(H-,13,14)/p+1 ChemAxon inchikey BYQQTWROSPBRIU-UHFFFAOYSA-O ChemAxon polar_surface_area 44.34 ChemAxon refractivity 64.12 ChemAxon polarizability 19.48 ChemAxon rotatable_bond_count 1 ChemAxon acceptor_count 2 ChemAxon donor_count 2 ChemAxon physiological_charge 0 ChemAxon formal_charge 1 ChemAxon Specdb::CMs 17874 Specdb::CMs 46956 Specdb::CMs 163119 Specdb::MsMs 305584 Specdb::MsMs 305585 Specdb::MsMs 305586 Specdb::MsMs 2665321 Specdb::MsMs 2665322 Specdb::MsMs 2665323 Specdb::NmrOneD 43262 Specdb::NmrOneD 43263 Specdb::NmrOneD 43264 Specdb::NmrOneD 43265 Specdb::NmrOneD 43266 Specdb::NmrOneD 43267 Specdb::NmrOneD 43268 Specdb::NmrOneD 43269 Specdb::NmrOneD 43270 Specdb::NmrOneD 43271 Specdb::NmrOneD 43272 Specdb::NmrOneD 43273 Specdb::NmrOneD 43274 Specdb::NmrOneD 43275 Specdb::NmrOneD 43276 Specdb::NmrOneD 43277 Specdb::NmrOneD 43278 Specdb::NmrOneD 43279 Specdb::NmrOneD 43280 Specdb::NmrOneD 43281 HMDB40768 #<Reference:0x000055ce317edf88> Fruits Unknown generic