898776-95-9
4'-PYRROLIDINOMETHYL-3,4,5-TRIFLUOROBENZOPHENONE
Name4'-PYRROLIDINOMETHYL-3,4,5-TRIFLUOROBENZOPHENONE
1Identification
【Name】
4'-PYRROLIDINOMETHYL-3,4,5-TRIFLUOROBENZOPHENONE
【CAS】
【MDL】
MFCD03841542
【English Synonyms】
【Formula】
C18 H16 F3 N O
【MolWeight】
319.324
【Inchi】
InChI=1S/C18H16F3NO/c19-15-9-14(10-16(20)17(15)21)18(23)13-5-3-12(4-6-13)11-22-7-1-2-8-22/h3-6,9-10H,1-2,7-8,11H2
【InChIKey】
InChIKey=BKXMGIRCUCLVOK-UHFFFAOYSA-N
【SMILES】
c1cc(ccc1CN2CCCC2)C(=O)c3cc(c(c(c3)F)F)F
【MOL File】
4'-PYRROLIDINOMETHYL….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:2
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4'-PYRROLIDINOMETHYL-3,4,5-TRIFLUOROBENZOPHENONE.cml