926257-97-8
5-(4-FLUORO-PHENOXY)-3-METHYL-1-PHENYL-1H-PYRAZOLE-4-CARBALDEHYDE
Name5-(4-FLUORO-PHENOXY)-3-METHYL-1-PHENYL-1H-PYRAZOLE-4-CARBALDEHYDE
1Identification
【Name】
5-(4-FLUORO-PHENOXY)-3-METHYL-1-PHENYL-1H-PYRAZOLE-4-CARBALDEHYDE
【CAS】
【MDL】
MFCD03950729
【English Synonyms】
【Formula】
C17 H13 F N2 O2
【MolWeight】
296.3
【Inchi】
InChI=1S/C17H13FN2O2/c1-12-16(11-21)17(22-15-9-7-13(18)8-10-15)20(19-12)14-5-3-2-4-6-14/h2-11H,1H3
【InChIKey】
InChIKey=XNKFNEYDDWWPOK-UHFFFAOYSA-N
【SMILES】
Cc1c(c(n(n1)c2ccccc2)Oc3ccc(cc3)F)C=O
【MOL File】
5-(4-FLUORO-PHENOXY)….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:4
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
5-(4-FLUORO-PHENOXY)-3-METHYL-1-PHENYL-1H-PYRAZOLE-4-CARBALDEHYDE.cml