1072944-69-4
METHYL 4-HYDROXY-7-(TRIFLUOROMETHYL)QUINOLINE-2-CARBOXYLATE
NameMETHYL 4-HYDROXY-7-(TRIFLUOROMETHYL)QUINOLINE-2-CARBOXYLATE
pro_formulaC12 H8 F3 N O3
1Identification
【Name】
METHYL 4-HYDROXY-7-(TRIFLUOROMETHYL)QUINOLINE-2-CARBOXYLATE
【CAS】
【MDL】
MFCD11504916
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C12 H8 F3 N O3
【pro_molWeight】
271.193
【Inchi】
InChI=1S/C12H8F3NO3/c1-19-11(18)9-5-10(17)7-3-2-6(12(13,14)15)4-8(7)16-9/h2-5H,1H3,(H,16,17)
【InChIKey】
InChIKey=HXMSYFTWUSYAPH-UHFFFAOYSA-N
【SMILES】
COC(=O)c1cc(c2ccc(cc2n1)C(F)(F)F)O
【MOL File】
METHYL 4-HYDROXY-7-(….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:1
pro_acceptors:4
XLogP3:2.0
Bulk/Fine:FB
3MaterialMSDS
4CMLFile
METHYL 4-HYDROXY-7-(TRIFLUOROMETHYL)QUINOLINE-2-CARBOXYLATE.cml