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(5R,6S)-2-Mesityl-5,6-diphenyl-6,8-dihydro-5H-[1,2,4]triazolo[3,4-c][1,4]oxazin-2-ium tetrafluoroborate

(5R,6S)-2-Mesityl-5,6-diphenyl-6,8-dihydro-5H-[1,2,4]triazolo[3,4-c][1,4]oxazin-2-ium tetrafluoroborate - CAS 950842-71-4

(5R,6S)-2-Mesityl-5,6-diphenyl-6,8-dihydro-5H-[1,2,4]triazolo[3,4-c][1,4]oxazin-2-ium tetrafluoroborate is a chiral catalyst that has been intensively applied in asymmetric reactions with high atom economy.

Catalog Number

950842-71-4

CAS

950842-71-4

IUPAC Name

(5R,6S)-5,6-diphenyl-2-(2,4,6-trimethylphenyl)-6,8-dihydro-5H-[1,2,4]triazolo[3,4-c][1,4]oxazin-4-ium;tetrafluoroborate

Molecular Weight

483.31

Molecular Formula

C26H26BF4N3O

Product Information

Canonical SMILES

F[B-](F)(F)F.Cc1cc(C)c(c(C)c1)-[n+]2cn3[C@@H]([C@@H](OCc3n2)c4ccccc4)c5ccccc5

InChI

InChI=1S/C26H26N3O.BF4/c1-18-14-19(2)24(20(3)15-18)29-17-28-23(27-29)16-30-26(22-12-8-5-9-13-22)25(28)21-10-6-4-7-11-21;2-1(3,4)5/h4-15,17,25-26H,16H2,1-3H3;/q+1;-1/t25-,26+;/m1./s1

InChI Key

OBABAEBTRZTTCY-QGLFPKSOSA-N

Purity

97%

WGK Germany

The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

Mass