146824-84-2
6-METHYL-3-(2-QUINOLINYLMETHOXY)-1-(3-(TRIFLUOROMETHYL)PHENYL)-4(1H)-PYRIDAZINONE
Name6-METHYL-3-(2-QUINOLINYLMETHOXY)-1-(3-(TRIFLUOROMETHYL)PHENYL)-4(1H)-PYRIDAZINONE
1Identification
【Name】
6-METHYL-3-(2-QUINOLINYLMETHOXY)-1-(3-(TRIFLUOROMETHYL)PHENYL)-4(1H)-PYRIDAZINONE
【CAS】
【MDL】
MFCD01758446
【English Synonyms】
【Formula】
C22 H16 F3 N3 O2
【MolWeight】
411.381
【Inchi】
InChI=1S/C22H16F3N3O2/c1-14-11-20(29)21(27-28(14)18-7-4-6-16(12-18)22(23,24)25)30-13-17-10-9-15-5-2-3-8-19(15)26-17/h2-12H,13H2,1H3
【InChIKey】
InChIKey=MEDBYYVLGPWKFQ-UHFFFAOYSA-N
【SMILES】
Cc1cc(=O)c(nn1c2cccc(c2)C(F)(F)F)OCc3ccc4ccccc4n3
【MOL File】
6-METHYL-3-(2-QUINOL….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:5
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
6-METHYL-3-(2-QUINOLINYLMETHOXY)-1-(3-(TRIFLUOROMETHYL)PHENYL)-4(1H)-PYRIDAZINONE.cml