625127-11-9
5-FLUORO-7-(TRIFLUOROMETHYL)-1,2,3,4-TETRAHYDROISOQUINOLINE
Name5-FLUORO-7-(TRIFLUOROMETHYL)-1,2,3,4-TETRAHYDROISOQUINOLINE
1Identification
【Name】
5-FLUORO-7-(TRIFLUOROMETHYL)-1,2,3,4-TETRAHYDROISOQUINOLINE
【CAS】
【MDL】
MFCD17010028
【English Synonyms】
【Formula】
C10 H9 F4 N
【MolWeight】
219.18
【Inchi】
InChI=1S/C10H9F4N/c11-9-4-7(10(12,13)14)3-6-5-15-2-1-8(6)9/h3-4,15H,1-2,5H2
【InChIKey】
InChIKey=LXWUEYKQVZSKKB-UHFFFAOYSA-N
【SMILES】
c1c(cc(c2c1CNCC2)F)C(F)(F)F
【MOL File】
5-FLUORO-7-(TRIFLUOR….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:1
XLogP3:2.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
5-FLUORO-7-(TRIFLUOROMETHYL)-1,2,3,4-TETRAHYDROISOQUINOLINE.cml