541505-15-1
3-QUINOLINECARBONITRILE, 7-FLUORO-4-HYDROXY-5-[(TETRAHYDRO-2H-PYRAN-4-YL)OXY]-
Name3-QUINOLINECARBONITRILE, 7-FLUORO-4-HYDROXY-5-[(TETRAHYDRO-2H-PYRAN-4-YL)OXY]-
1Identification
【Name】
3-QUINOLINECARBONITRILE, 7-FLUORO-4-HYDROXY-5-[(TETRAHYDRO-2H-PYRAN-4-YL)OXY]-
【CAS】
【MDL】
MFCD13181112
【English Synonyms】
【Formula】
C15 H13 F N2 O3
【MolWeight】
288.277
【Inchi】
InChI=1S/C15H13FN2O3/c16-10-5-12-14(15(19)9(7-17)8-18-12)13(6-10)21-11-1-3-20-4-2-11/h5-6,8,11H,1-4H2,(H,18,19)
【InChIKey】
InChIKey=KHTVVHHRVQJJSS-UHFFFAOYSA-N
【SMILES】
c1c(cc(c2c1ncc(c2O)C#N)OC3CCOCC3)F
【MOL File】
3-QUINOLINECARBONITR….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-QUINOLINECARBONITRILE, 7-FLUORO-4-HYDROXY-5-[(TETRAHYDRO-2H-PYRAN-4-YL)OXY]-.cml