20124-87-2
5-ME-2-PH-4-((3-(TRIFLUOROMETHYL)PHENYL)DIAZENYL)-2,4-DIHYDRO-3H-PYRAZOL-3-ONE
Name5-ME-2-PH-4-((3-(TRIFLUOROMETHYL)PHENYL)DIAZENYL)-2,4-DIHYDRO-3H-PYRAZOL-3-ONE
1Identification
【Name】
5-ME-2-PH-4-((3-(TRIFLUOROMETHYL)PHENYL)DIAZENYL)-2,4-DIHYDRO-3H-PYRAZOL-3-ONE
【CAS】
【MDL】
MFCD03037438
【English Synonyms】
【Formula】
C17 H13 F3 N4 O
【MolWeight】
346.311
【Inchi】
InChI=1S/C17H13F3N4O/c1-11-15(16(25)24(23-11)14-8-3-2-4-9-14)22-21-13-7-5-6-12(10-13)17(18,19)20/h2-10,15H,1H3/b22-21+
【InChIKey】
InChIKey=FKWMBTLYMSRLML-QURGRASLSA-N
【SMILES】
CC1=NN(C(=O)C1/N=N/c2cccc(c2)C(F)(F)F)c3ccccc3
【MOL File】
5-ME-2-PH-4-((3-(TRI….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:5
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
5-ME-2-PH-4-((3-(TRIFLUOROMETHYL)PHENYL)DIAZENYL)-2,4-DIHYDRO-3H-PYRAZOL-3-ONE.cml