194805-07-7
ETHYL 7-BROMO-1-CYCLOPROPYL-8-(DIFLUOROMETHOXY)-4-OXO-1,4-DIHYDROQUINOLINE-3-CARBOXYLATE
NameETHYL 7-BROMO-1-CYCLOPROPYL-8-(DIFLUOROMETHOXY)-4-OXO-1,4-DIHYDROQUINOLINE-3-CARBOXYLATE
FormulaC16 H14 Br F2 N O4
1Identification
【Name】
ETHYL 7-BROMO-1-CYCLOPROPYL-8-(DIFLUOROMETHOXY)-4-OXO-1,4-DIHYDROQUINOLINE-3-CARBOXYLATE
【CAS】
【MDL】
MFCD09743440
【English Synonyms】
【Formula】
C16 H14 Br F2 N O4
【MolWeight】
402.19
【Inchi】
InChI=1S/C16H14BrF2NO4/c1-2-23-15(22)10-7-20(8-3-4-8)12-9(13(10)21)5-6-11(17)14(12)24-16(18)19/h5-8,16H,2-4H2,1H3
【InChIKey】
InChIKey=ZVUUANRFLJIZGV-UHFFFAOYSA-N
【SMILES】
CCOC(=O)c1cn(c2c(c1=O)ccc(c2OC(F)F)Br)C3CC3
【MOL File】
ETHYL 7-BROMO-1-CYCL….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:5
XLogP3:4.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
ETHYL 7-BROMO-1-CYCLOPROPYL-8-(DIFLUOROMETHOXY)-4-OXO-1,4-DIHYDROQUINOLINE-3-CARBOXYLATE.cml