(S)-5-Benzyl-2-(perfluorophenyl)-2,5,6,8-tetrahydro-[1,2,4]triazolo[3,4-c][1,4]oxazin-4-ium tetrafluoroborate

Catalog Number	ACM1327274338
CAS	1327274-33-8
Synonyms	(5S)-5-Benzyl-2-(2,3,4,5,6-Pentafluorophenyl)-6,8-Dihydro-5H-[1,2,4]Triazolo[3,4-C][1,4]Oxazin-4-Ium Tetrafluoroborate
IUPAC Name	(5S)-5-benzyl-2-(2,3,4,5,6-pentafluorophenyl)-6,8-dihydro-5H-[1,2,4]triazolo[3,4-c][1,4]oxazin-4-ium;tetrafluoroborate
Molecular Weight	469.11
Molecular Formula	C18H13BF9N3O
InChI	YCLQFLWNWVBBTP-MERQFXBCSA-N
InChI Key	InChI=1S/C18H13F5N3O.BF4/c19-13-14(20)16(22)18(17(23)15(13)21)26-9-25-11(7-27-8-12(25)24-26)6-10-4-2-1-3-5-10;2-1(3,4)5/h1-5,9,11H,6-8H2;/q+1;-1/t11-;/m0./s1
Melting Point	168-170 °C
Purity	95%
Isomeric SMILES	[B-](F)(F)(F)F.C1[C@@H]([N+]2=CN(N=C2CO1)C3=C(C(=C(C(=C3F)F)F)F)F)CC4=CC=CC=C4