1.0 2010-04-08 22:14:59 UTC 2019-11-26 03:18:52 UTC FDB020383 Eduline Alkaloid from seeds of Casimiroa edulis (Mexican apple). Eduline is found in pomes. 6-Methoxy-1-methyl-2-phenyl-4(1H)-quinolinone, 9CI Eduline O-butyrotoluidide O-butyrotoluidine C17H15NO2 265.3065 265.110278729 6-methoxy-1-methyl-2-phenyl-1,4-dihydroquinolin-4-one 6-methoxy-1-methyl-2-phenylquinolin-4-one 6878-08-6 COC1=CC2=C(C=C1)N(C)C(=CC2=O)C1=CC=CC=C1 InChI=1S/C17H15NO2/c1-18-15-9-8-13(20-2)10-14(15)17(19)11-16(18)12-6-4-3-5-7-12/h3-11H,1-2H3 GFUAPSNFZWUMBP-UHFFFAOYSA-N belongs to the class of organic compounds known as phenylquinolines. These are heterocyclic compounds containing a quinoline moiety substituted with a phenyl group. Phenylquinolines Organic compounds Organoheterocyclic compounds Quinolines and derivatives Phenylquinolines Aromatic heteropolycyclic compounds Alkyl aryl ethers Anisoles Azacyclic compounds Benzene and substituted derivatives Heteroaromatic compounds Hydrocarbon derivatives Hydroquinolines Hydroquinolones Organic oxides Organonitrogen compounds Organopnictogen compounds Phenylpyridines Vinylogous amides 2-phenylpyridine Alkyl aryl ether Anisole Aromatic heteropolycyclic compound Azacycle Benzenoid Dihydroquinoline Dihydroquinolone Ether Heteroaromatic compound Hydrocarbon derivative Monocyclic benzene moiety Organic nitrogen compound Organic oxide Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Phenylquinoline Pyridine Vinylogous amide logp 3.26 ALOGPS logs -3.15 ALOGPS solubility 1.90e-01 g/l ALOGPS melting_point Mp 187-188° logp 2.93 ChemAxon pka_strongest_acidic 16.59 ChemAxon pka_strongest_basic 2.66 ChemAxon iupac 6-methoxy-1-methyl-2-phenyl-1,4-dihydroquinolin-4-one ChemAxon average_mass 265.3065 ChemAxon mono_mass 265.110278729 ChemAxon smiles COC1=CC2=C(C=C1)N(C)C(=CC2=O)C1=CC=CC=C1 ChemAxon formula C17H15NO2 ChemAxon inchi InChI=1S/C17H15NO2/c1-18-15-9-8-13(20-2)10-14(15)17(19)11-16(18)12-6-4-3-5-7-12/h3-11H,1-2H3 ChemAxon inchikey GFUAPSNFZWUMBP-UHFFFAOYSA-N ChemAxon polar_surface_area 29.54 ChemAxon refractivity 81.4 ChemAxon polarizability 29.3 ChemAxon rotatable_bond_count 2 ChemAxon acceptor_count 3 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 17895 Specdb::CMs 165296 Specdb::MsMs 305638 Specdb::MsMs 305639 Specdb::MsMs 305640 Specdb::MsMs 349084 Specdb::MsMs 349085 Specdb::MsMs 349086 Specdb::MsMs 2320646 Specdb::MsMs 2320647 Specdb::MsMs 2320648 Specdb::MsMs 2614123 Specdb::MsMs 2614124 Specdb::MsMs 2614125 HMDB40597 #<Reference:0x00007f093c019e00> Pomes Unknown generic