| Identification | Back Directory | [Name]
2,4-Diphenyl-6-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-1,3,5-triazine | [CAS]
1269508-31-7 | [Synonyms]
4-Diphenyl-6-[3-(4
2-dioxaborolan-2-yl)phenyl]-1
2,4-Diphenyl-6-(3-boronate)-1,3,5-triazine
3-(4,6-Diphenyl-1,3,5-triazine-2-yl)phenylboronic Acid Pinacol Ester
2-[3-(4,6-Diphenyl-1,3,5-triazin-2-yl)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
2,4-Diphenyl-6-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-1,3,5-triazine
2-[3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-4,6-diphenyl-1,3,5-triazine
1,3,5-Triazine, 2,4-diphenyl-6-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]- | [Molecular Formula]
C27H26BN3O2 | [MDL Number]
MFCD32062890 | [MOL File]
1269508-31-7.mol | [Molecular Weight]
435.325 |
| Chemical Properties | Back Directory | [Melting point ]
204 °C | [Boiling point ]
641.3±57.0 °C(Predicted) | [density ]
1.21±0.1 g/cm3(Predicted) | [form ]
powder to crystal | [pka]
0.92±0.10(Predicted) | [color ]
White to Almost white | [InChI]
InChI=1S/C27H26BN3O2/c1-26(2)27(3,4)33-28(32-26)22-17-11-16-21(18-22)25-30-23(19-12-7-5-8-13-19)29-24(31-25)20-14-9-6-10-15-20/h5-18H,1-4H3 | [InChIKey]
FXHGBACNYDFALU-UHFFFAOYSA-N | [SMILES]
N1=C(C2=CC=CC(B3OC(C)(C)C(C)(C)O3)=C2)N=C(C2=CC=CC=C2)N=C1C1=CC=CC=C1 |
| Hazard Information | Back Directory | [Uses]
2,4-Diphenyl-6-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-1,3,5-triazine can be used as an intermediate in organic
synthesis, mainly used in laboratory research and development and
chemical production processes. | [Synthesis]
15.0 g of 2-(3-Bromophenyl)-4,6-diphenyl-l,3,5-
triazine (32.4 mmol), 12.3 g of bis(pinacolato)diboron (48.6
mmol), 529 mg of Pd(dppf)Cl2.CH2Cl2 (0.647 mmol), 9.53
g of potassium acetate (97.1 mmol) and 323 ml of dioxane
were put into a 1-neck round flask and reacted under reflux
at 90° C. for 12 hours. After completion of the reaction, the solvent was removed under reduced pressure. The produced
solid was dissolved in dichloromethane and then filtered
through a Celite filter and washed with dichloromethane.
The solvent was removed under reduced pressure and the
resultant compound was crystallized with methanol to obtain
16.0 g of solid compound (intermediate 6) (yield: 96.8%). |
|
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