2-Pinacolateboryl indole

• CAS: 476004-81-6
• Catalog Number: ACM476004816
• Category: Other Products
• Molecular Weight: 243.11g/mol
• Molecular Formula: C14H18BNO2
• IUPAC Name: 2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole
• Canonical SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC3=CC=CC=C3N2
• InChI: InChI=1S/C14H18BNO2/c1-13(2)14(3,4)18-15(17-13)12-9-10-7-5-6-8-11(10)16-12/h5-9,16H,1-4H3
• InChI Key: IAQBURSQTCOSBP-UHFFFAOYSA-N
• Complexity: 316
• Covalently-Bonded Unit Count: 1
• Exact Mass: 243.143059g/mol
• Formal Charge: 0
• H-Bond Acceptor: 2
• H-Bond Donor: 1
• Heavy Atom Count: 18
• Monoisotopic Mass: 243.143059g/mol
• Rotatable Bond Count: 1

Synthetic Use

Upstream Synthesis Route 1

• 120-72-9
• 73183-34-3

• 476004-81-6

Reference: [1] Journal of the American Chemical Society, 2015, vol. 137, # 7, p. 2665 - 2673

Upstream Synthesis Route 2

• 120-72-9
• 25015-63-8

• 476004-81-6

Reference: [1] Chemical Communications, 2003, # 23, p. 2924 - 2925

Upstream Synthesis Route 3

• 76-09-5
• 116491-57-7

• 476004-81-6

Reference: [1]Organic Letters,2005,vol. 7,p. 2523 - 2526

Downstream Synthesis Route 1

• 476004-81-6

• 26340-49-8

Reference: [1] Organic Letters, 2013, vol. 15, # 1, p. 140 - 143

Downstream Synthesis Route 2

• 1003-09-4
• 476004-81-6

• 55968-16-6

Reference: [1]Tetrahedron,2008,vol. 64,p. 4967 - 4971

* For details of the synthesis route, please refer to the original source to ensure accuracy.