578709-07-6
2-PIPERIDIN-4-YL-6-TRIFLUOROMETHYL-1H-BENZOIMIDAZOLE
Name2-PIPERIDIN-4-YL-6-TRIFLUOROMETHYL-1H-BENZOIMIDAZOLE
1Identification
【Name】
2-PIPERIDIN-4-YL-6-TRIFLUOROMETHYL-1H-BENZOIMIDAZOLE
【CAS】
【MDL】
MFCD16658511
【English Synonyms】
【Formula】
C13 H14 F3 N3
【MolWeight】
269.269
【Inchi】
InChI=1S/C13H14F3N3/c14-13(15,16)9-1-2-10-11(7-9)19-12(18-10)8-3-5-17-6-4-8/h1-2,7-8,17H,3-6H2,(H,18,19)
【InChIKey】
InChIKey=BDJQEACTFJZNOC-UHFFFAOYSA-N
【SMILES】
c1cc2c(cc1C(F)(F)F)[nH]c(n2)C3CCNCC3
【MOL File】
2-PIPERIDIN-4-YL-6-T….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:3
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-PIPERIDIN-4-YL-6-TRIFLUOROMETHYL-1H-BENZOIMIDAZOLE.cml