587886-28-0
6-(TRIFLUOROMETHOXY)-2-(TRIFLUOROMETHYL)QUINOLINE-3-CARBOXYLIC ACID
Name6-(TRIFLUOROMETHOXY)-2-(TRIFLUOROMETHYL)QUINOLINE-3-CARBOXYLIC ACID
1Identification
【Name】
6-(TRIFLUOROMETHOXY)-2-(TRIFLUOROMETHYL)QUINOLINE-3-CARBOXYLIC ACID
【CAS】
【MDL】
MFCD20925974
【English Synonyms】
【Formula】
C12 H5 F6 N O3
【MolWeight】
325.164
【Inchi】
InChI=1S/C12H5F6NO3/c13-11(14,15)9-7(10(20)21)4-5-3-6(22-12(16,17)18)1-2-8(5)19-9/h1-4H,(H,20,21)
【InChIKey】
InChIKey=RMNRQJPEPKVJBK-UHFFFAOYSA-N
【SMILES】
c1cc2c(cc1OC(F)(F)F)cc(c(n2)C(F)(F)F)C(=O)O
【MOL File】
6-(TRIFLUOROMETHOXY)….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
6-(TRIFLUOROMETHOXY)-2-(TRIFLUOROMETHYL)QUINOLINE-3-CARBOXYLIC ACID.cml