53985-73-2
4-HYDROXY-7-TRIFLUOROMETHOXYQUINOLINE-3-CARBOXYLIC ACID ETHYL ESTER
Name4-HYDROXY-7-TRIFLUOROMETHOXYQUINOLINE-3-CARBOXYLIC ACID ETHYL ESTER
1Identification
【Name】
4-HYDROXY-7-TRIFLUOROMETHOXYQUINOLINE-3-CARBOXYLIC ACID ETHYL ESTER
【CAS】
【MDL】
MFCD13192936
【English Synonyms】
【Formula】
C13 H10 F3 N O4
【MolWeight】
301.219
【Inchi】
InChI=1S/C13H10F3NO4/c1-2-20-12(19)9-6-17-10-5-7(21-13(14,15)16)3-4-8(10)11(9)18/h3-6H,2H2,1H3,(H,17,18)
【InChIKey】
InChIKey=GWZQMWHKZFRHML-UHFFFAOYSA-N
【SMILES】
CCOC(=O)c1cnc2cc(ccc2c1O)OC(F)(F)F
【MOL File】
4-HYDROXY-7-TRIFLUOR….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-HYDROXY-7-TRIFLUOROMETHOXYQUINOLINE-3-CARBOXYLIC ACID ETHYL ESTER.cml