628326-20-5
1-[2-FLUORO-6-(4-METHYL-1-PIPERAZINYL)PHENYL]-ETHANONE
Name1-[2-FLUORO-6-(4-METHYL-1-PIPERAZINYL)PHENYL]-ETHANONE
1Identification
【Name】
1-[2-FLUORO-6-(4-METHYL-1-PIPERAZINYL)PHENYL]-ETHANONE
【CAS】
【MDL】
MFCD11136767
【English Synonyms】
【Formula】
C13 H17 F N2 O
【MolWeight】
236.288
【Inchi】
InChI=1S/C13H17FN2O/c1-10(17)13-11(14)4-3-5-12(13)16-8-6-15(2)7-9-16/h3-5H,6-9H2,1-2H3
【InChIKey】
InChIKey=IETHGJKSHXKFER-UHFFFAOYSA-N
【SMILES】
CC(=O)c1c(cccc1F)N2CCN(CC2)C
【MOL File】
1-[2-FLUORO-6-(4-MET….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:3
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-[2-FLUORO-6-(4-METHYL-1-PIPERAZINYL)PHENYL]-ETHANONE.cml