1435467-29-0

Basic information

• Product Name: (S,R)-BDTBIn-SaBOX
• Synonyms: (S,R)-BDTBIn-SaBOX;(3aS,3a'S,8aR,8a'R)-2,2'-(1,3-Bis(3,5-di-t-butylphenyl)propane-2,2-diyl)bis(8,8a-dihydro-3aH-indeno[1,2-d]oxazole) (S,R)-BDTBIn-SaBOX
• CAS NO: 1435467-29-0
• Molecular Formula: C₅₁H₆₂N₂O₂
• Molecular Weight: 735.05018
• Product Categories: BOX series;Chiral Nitrogen
• Mol File: 1435467-29-0.mol
• Article Data: 1

Chemical Properties

• Boiling Point: 739.4±60.0 °C(Predicted)
• Appearance: white/solid
• Density: 1.11±0.1 g/cm3(Predicted)
• PKA: 5.47±0.20(Predicted)
• CAS DataBase Reference: (S,R)-BDTBIn-SaBOX(CAS DataBase Reference)
• NIST Chemistry Reference: (S,R)-BDTBIn-SaBOX(1435467-29-0)
• EPA Substance Registry System: (S,R)-BDTBIn-SaBOX(1435467-29-0)

Safety Data

• Statements: 36/37/38
• Safety Statements: 26-36
• Hazardous Substances Data: 1435467-29-0(Hazardous Substances Data)

Usage

Reaction

Ligand used in the copper-catalyzed, highly enantioselective cyclopentannulation of indoles with donor-acceptor cyclopropanes.

Chemical Properties

White powder

Upstream product

• 62938-08-3 3,5-di-tert-butylbenzyl bromide 
• 175166-49-1 [3aS-[2(3'aR*,8'aS*),3a,8a]]methylenebis[3a,8a-dihydro-8H-indeno[1,2-d]oxazole] 

Relevant articles and documents

Copper-catalyzed highly enantioselective cyclopentannulation of indoles with donor-acceptor cyclopropanes

A highly diastereo- and enantioselective BOX/Cu(II)-catalyzed C2,C3-cyclopentannulation of indoles with donor-acceptor cyclopropanes has been developed on the basis of asymmetric formal [3 + 2] cycloaddition of indoles. This reaction provides rapid and facile access to a series of enantioenriched cyclopenta-fused indoline products and can be further extended to the construction of tetracyclic pyrroloindolines. The synthetic potential of the reaction was demonstrated in a four-step synthesis of the core structure of borreverine.