1188198-30-2
3-(2,3-DIFLUOROPHENYL)-5-[4-(1-METHYLETHYL)PHENYL]-4-ISOXAZOLECARBOXYLIC ACID ETHYL ESTER
Name3-(2,3-DIFLUOROPHENYL)-5-[4-(1-METHYLETHYL)PHENYL]-4-ISOXAZOLECARBOXYLIC ACID ETHYL ESTER
1Identification
【Name】
3-(2,3-DIFLUOROPHENYL)-5-[4-(1-METHYLETHYL)PHENYL]-4-ISOXAZOLECARBOXYLIC ACID ETHYL ESTER
【CAS】
【MDL】
MFCD17183521
【English Synonyms】
【Formula】
C21 H19 F2 N O3
【MolWeight】
371.381
【Inchi】
InChI=1S/C21H19F2NO3/c1-4-26-21(25)17-19(15-6-5-7-16(22)18(15)23)24-27-20(17)14-10-8-13(9-11-14)12(2)3/h5-12H,4H2,1-3H3
【InChIKey】
InChIKey=BPISRVQOTOOTLD-UHFFFAOYSA-N
【SMILES】
CCOC(=O)c1c(noc1c2ccc(cc2)C(C)C)c3cccc(c3F)F
【MOL File】
3-(2,3-DIFLUOROPHENY….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:4
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-(2,3-DIFLUOROPHENYL)-5-[4-(1-METHYLETHYL)PHENYL]-4-ISOXAZOLECARBOXYLIC ACID ETHYL ESTER.cml