1.0 2016-09-30 23:20:46 UTC 2020-04-22 15:17:02 UTC BMDB0006240 BMDB06240 Demethylated antipyrine 1-Phenyl-3-methyl-1H-4,5-dihydropyrazol-5-one 1-Phenyl-3-methyl-2-pyrazolin-5-one 1-Phenyl-3-methyl-5-oxopyrazole 1-Phenyl-3-methyl-5-pyrazolinone 1-Phenyl-3-methyl-5-pyrazolone 2,4-dihydro-5-Methyl-2-phenyl-3H-pyrazol-3-one 3-Methyl-1-phenyl-1H-pyrazol-5-one 3-Methyl-1-phenyl-2-pyrazolin-5-one 3-Methyl-1-phenyl-2-pyrazoline-5-one 3-Methyl-1-phenyl-4,5-dihydropyrazol-5-one 3-Methyl-1-phenyl-4,5-dihydropyrazole-5-one 3-Methyl-1-phenyl-5-pyrazolone 3-Methyl-1-phenylpyrazol-5(4H)-one 3-Methyl-1-phenylpyrazolin-5-one 5-Methyl-2-phenyl-2H-pyrazol-3(4H)-one 5-Methyl-2-phenylpyrazol-3-one Edarabone Edaravone Methylphenylpyrazolone Norantipyrine Norphenazone N-Demethylantipyrine, 14C-labeled N-Demethylantipyrine C10H10N2O 174.1992 174.079312952 5-methyl-2-phenyl-2,3-dihydro-1H-pyrazol-3-one 5-methyl-2-phenyl-1H-pyrazol-3-one 89-25-8 CC1=CC(=O)N(N1)C1=CC=CC=C1 InChI=1S/C10H10N2O/c1-8-7-10(13)12(11-8)9-5-3-2-4-6-9/h2-7,11H,1H3 KZQYIMCESJLPQH-UHFFFAOYSA-N belongs to the class of organic compounds known as phenylpyrazoles. Phenylpyrazoles are compounds containing a phenylpyrazole skeleton, which consists of a pyrazole bound to a phenyl group. Organic compounds Organoheterocyclic compounds Azoles Pyrazoles Phenylpyrazoles Azacyclic compounds Benzene and substituted derivatives Heteroaromatic compounds Hydrocarbon derivatives Lactams Organic oxides Organonitrogen compounds Organooxygen compounds Organopnictogen compounds Pyrazolones Vinylogous amides Aromatic heteromonocyclic compound Azacycle Benzenoid Heteroaromatic compound Hydrocarbon derivative Lactam Monocyclic benzene moiety Organic nitrogen compound Organic oxide Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Phenylpyrazole Pyrazolinone Vinylogous amide Aromatic heteromonocyclic compounds Solid melting_point 130 °C logp 0.59 ALOGPS logs -0.96 ALOGPS logp 1.28 ChemAxon pka_strongest_acidic 8.27 ChemAxon pka_strongest_basic 1.62 ChemAxon iupac 5-methyl-2-phenyl-2,3-dihydro-1H-pyrazol-3-one ChemAxon average_mass 174.1992 ChemAxon mono_mass 174.079312952 ChemAxon smiles CC1=CC(=O)N(N1)C1=CC=CC=C1 ChemAxon formula C10H10N2O ChemAxon inchi InChI=1S/C10H10N2O/c1-8-7-10(13)12(11-8)9-5-3-2-4-6-9/h2-7,11H,1H3 ChemAxon inchikey KZQYIMCESJLPQH-UHFFFAOYSA-N ChemAxon polar_surface_area 32.34 ChemAxon refractivity 62.14 ChemAxon polarizability 18.55 ChemAxon rotatable_bond_count 1 ChemAxon acceptor_count 2 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon number_of_rings 2 ChemAxon bioavailability 1 ChemAxon rule_of_five Yes ChemAxon ghose_filter Yes ChemAxon veber_rule Yes ChemAxon mddr_like_rule Yes ChemAxon Specdb::CMs 15851 Specdb::CMs 133435 Specdb::CMs 141169 Specdb::MsMs 301123 Specdb::MsMs 301124 Specdb::MsMs 301125 Specdb::MsMs 343573 Specdb::MsMs 343574 Specdb::MsMs 343575 Specdb::MsMs 2262640 Specdb::MsMs 2262641 Specdb::MsMs 2262642 Specdb::MsMs 3080274 Specdb::MsMs 3080275 Specdb::MsMs 3080276 Specdb::NmrOneD 67952 Specdb::NmrOneD 67953 Specdb::NmrOneD 67954 Specdb::NmrOneD 67955 Specdb::NmrOneD 67956 Specdb::NmrOneD 67957 Specdb::NmrOneD 67958 Specdb::NmrOneD 67959 Specdb::NmrOneD 67960 Specdb::NmrOneD 67961 Specdb::NmrOneD 67962 Specdb::NmrOneD 67963 Specdb::NmrOneD 67964 Specdb::NmrOneD 67965 Specdb::NmrOneD 67966 Specdb::NmrOneD 67967 Specdb::NmrOneD 67968 Specdb::NmrOneD 67969 Specdb::NmrOneD 67970 Specdb::NmrOneD 67971 Specdb::MsIr 2380 Specdb::MsIr 2381 Specdb::MsIr 2382 63516 FDB023854 70335 C13008 31530 2299979 Rojahn, C. A. 1-Alkyl-3-chloropyrazoles and 1-alkyl-3-pyrazolones. Berichte der Deutschen Chemischen Gesellschaft [Abteilung] B: Abhandlungen (1922), 55B 2959-71. CODEN: BDCBAD ISSN:0365-9488. CAN 17:6867 AN 1923:6867 CAPLUS