478031-33-3
N-(3,4-DIFLUOROPHENYL)-3,5-DIMETHYL-4-ISOXAZOLECARBOXAMIDE
NameN-(3,4-DIFLUOROPHENYL)-3,5-DIMETHYL-4-ISOXAZOLECARBOXAMIDE
1Identification
【Name】
N-(3,4-DIFLUOROPHENYL)-3,5-DIMETHYL-4-ISOXAZOLECARBOXAMIDE
【CAS】
【MDL】
MFCD00794389
【English Synonyms】
【Formula】
C12 H10 F2 N2 O2
【MolWeight】
252.219
【Inchi】
InChI=1S/C12H10F2N2O2/c1-6-11(7(2)18-16-6)12(17)15-8-3-4-9(13)10(14)5-8/h3-5H,1-2H3,(H,15,17)
【InChIKey】
InChIKey=ANBYWDHBZZUZFZ-UHFFFAOYSA-N
【SMILES】
Cc1c(c(on1)C)C(=O)Nc2ccc(c(c2)F)F
【MOL File】
N-(3,4-DIFLUOROPHENY….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
N-(3,4-DIFLUOROPHENYL)-3,5-DIMETHYL-4-ISOXAZOLECARBOXAMIDE.cml