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| IUPAC Name: | ditert-butyl-[2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]phosphane |
| Description: | tBuXPhos has been used in the preparation of [tBuXPhosAu(MeCN)]BAr4F, a gold catalyst for the intermolecular [2+2] cycloaddition of terminal arylalkynes with substituted alkenes to form functionalized cyclobutenes with high regioselectivity. tBuXPhos is a ligand for Pd-catalyzed C-O and C-N bond formation.It can be used in the following reactions: Palladium-catalyzed Tsuji-Trost substitution and cross-coupling of benzylic fluorides; Palladium-catalyzed C-N cross-coupling of sulfinamides and aryl halides; Palladium-catalyzed rapid methoxylation and deuteriomethoxylation of bromo-chalcones. |
| Molecular Weight: | 424.64 |
| Molecular Formula: | C29H45P |
| Canonical SMILES: | CC(C)C1=CC(=C(C(=C1)C(C)C)C2=CC=CC=C2P(C(C)(C)C)C(C)(C)C)C(C)C |
| InChI: | InChI=1S/C29H45P/c1-19(2)22-17-24(20(3)4)27(25(18-22)21(5)6)23-15-13-14-16-26(23)30(28(7,8)9)29(10,11)12/h13-21H,1-12H3 |
| InChI Key: | SACNIGZYDTUHKB-UHFFFAOYSA-N |
| Boiling Point: | 493.479 ℃ at 760 mmHg |
| Melting Point: | 148-151 ℃ (lit.) |
| Flash Point: | Not applicable |
| Purity: | 98 % |
| MDL: | MFCD06411306 |
| LogP: | 9.42800 |
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