1188067-65-3
3-(3,4-DIFLUOROPHENYL)-5-[2-(TRIFLUOROMETHYL)PHENYL]-4-ISOXAZOLECARBOXYLIC ACID ETHYL ESTER
Name3-(3,4-DIFLUOROPHENYL)-5-[2-(TRIFLUOROMETHYL)PHENYL]-4-ISOXAZOLECARBOXYLIC ACID ETHYL ESTER
1Identification
【Name】
3-(3,4-DIFLUOROPHENYL)-5-[2-(TRIFLUOROMETHYL)PHENYL]-4-ISOXAZOLECARBOXYLIC ACID ETHYL ESTER
【CAS】
【MDL】
MFCD17183308
【English Synonyms】
【Formula】
C19 H12 F5 N O3
【MolWeight】
397.298
【Inchi】
InChI=1S/C19H12F5NO3/c1-2-27-18(26)15-16(10-7-8-13(20)14(21)9-10)25-28-17(15)11-5-3-4-6-12(11)19(22,23)24/h3-9H,2H2,1H3
【InChIKey】
InChIKey=ISEHZWMSNZFIHJ-UHFFFAOYSA-N
【SMILES】
CCOC(=O)c1c(noc1c2ccccc2C(F)(F)F)c3ccc(c(c3)F)F
【MOL File】
3-(3,4-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-(3,4-DIFLUOROPHENYL)-5-[2-(TRIFLUOROMETHYL)PHENYL]-4-ISOXAZOLECARBOXYLIC ACID ETHYL ESTER.cml