1.0 2010-04-08 22:14:33 UTC 2015-07-21 06:38:09 UTC FDB019730 3-(2-Furanylmethylene)pyrrolidine Putative proline-derived Maillard product formed in model reactions with proline or 1-pyrroline and ascorbic acid 3-Furfurylidenepyrrolidine C9H11NO 149.1897 149.084063979 (3Z)-3-(furan-2-ylmethylidene)pyrrolidine (3Z)-3-(furan-2-ylmethylidene)pyrrolidine 118248-35-4 C1C\C(CN1)=C\C1=CC=CO1 InChI=1S/C9H11NO/c1-2-9(11-5-1)6-8-3-4-10-7-8/h1-2,5-6,10H,3-4,7H2/b8-6- PNXWYJGINUMYJQ-VURMDHGXSA-N belongs to the class of organic compounds known as heteroaromatic compounds. Heteroaromatic compounds are compounds containing an aromatic ring where a carbon atom is linked to an hetero atom. Heteroaromatic compounds Organic compounds Organoheterocyclic compounds Heteroaromatic compounds Aromatic heteromonocyclic compounds Azacyclic compounds Dialkylamines Furans Hydrocarbon derivatives Organooxygen compounds Organopnictogen compounds Oxacyclic compounds Pyrrolidines Amine Aromatic heteromonocyclic compound Azacycle Furan Heteroaromatic compound Hydrocarbon derivative Organic nitrogen compound Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Oxacycle Pyrrolidine Secondary aliphatic amine Secondary amine logp 0.85 ALOGPS logs -1.50 ALOGPS solubility 4.72e+00 g/l ALOGPS logp 0.97 ChemAxon pka_strongest_basic 10.02 ChemAxon iupac (3Z)-3-(furan-2-ylmethylidene)pyrrolidine ChemAxon average_mass 149.1897 ChemAxon mono_mass 149.084063979 ChemAxon smiles C1C\C(CN1)=C\C1=CC=CO1 ChemAxon formula C9H11NO ChemAxon inchi InChI=1S/C9H11NO/c1-2-9(11-5-1)6-8-3-4-10-7-8/h1-2,5-6,10H,3-4,7H2/b8-6- ChemAxon inchikey PNXWYJGINUMYJQ-VURMDHGXSA-N ChemAxon polar_surface_area 25.17 ChemAxon refractivity 44.57 ChemAxon polarizability 16.59 ChemAxon rotatable_bond_count 1 ChemAxon acceptor_count 1 ChemAxon donor_count 1 ChemAxon physiological_charge 1 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 25418 Specdb::CMs 149092 Specdb::MsIr 8537 Specdb::MsIr 8538 Specdb::MsIr 8539 Specdb::NmrOneD 38142 Specdb::NmrOneD 38143 Specdb::NmrOneD 38144 Specdb::NmrOneD 38145 Specdb::NmrOneD 38146 Specdb::NmrOneD 38147 Specdb::NmrOneD 38148 Specdb::NmrOneD 38149 Specdb::NmrOneD 38150 Specdb::NmrOneD 38151 Specdb::NmrOneD 38152 Specdb::NmrOneD 38153 Specdb::NmrOneD 38154 Specdb::NmrOneD 38155 Specdb::NmrOneD 38156 Specdb::NmrOneD 38157 Specdb::NmrOneD 38158 Specdb::NmrOneD 38159 Specdb::NmrOneD 38160 Specdb::NmrOneD 38161 Specdb::MsMs 322312 Specdb::MsMs 322313 Specdb::MsMs 322314 Specdb::MsMs 370183 Specdb::MsMs 370184 Specdb::MsMs 370185 Specdb::MsMs 3040867 Specdb::MsMs 3040868 Specdb::MsMs 3040869 Specdb::MsMs 3102215 Specdb::MsMs 3102216 Specdb::MsMs 3102217 HMDB40043 #<Reference:0x000055ce307a6648>