3-Isocyanatophenylboronic acid, pinacol ester, 96%

cas: 787591-43-9 — see every product listed under this CAS number, including other names

3-Isocyanatophenylboronic acid, pinacol ester, 96% (CAS 787591-43-9) is a chemical reagent available from Chemat. Available pack sizes: 5g, 10g, 1g. Offered by: Combi-blocks.

• 2D
• 3D

2-(3-isocyanatophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane (CAS 787591-43-9) is a chemical compound with the molecular formula C13H16BNO3 and a molecular weight of 245.08 g/mol. IUPAC name: 2-(3-isocyanatophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane. InChIKey: VSAATWKRRDGVOD-UHFFFAOYSA-N.

Identity

Molecular formula	C13H16BNO3
Molecular weight	245.08 g/mol
IUPAC name	2-(3-isocyanatophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChIKey	VSAATWKRRDGVOD-UHFFFAOYSA-N
SMILES	B1(OC(C(O1)(C)C)(C)C)C2=CC(=CC=C2)N=C=O

Computed by PubChem (NCBI)

Synonyms: 2-(3-isocyanatophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane, 3-Isocyanatobenzeneboronic acid, pinacol ester, VSAATWKRRDGVOD-UHFFFAOYSA-N, 2-(3-isocyanato-phenyl)-4,4,5,5-tetramethyl-[1,3,2]dioxaborolane, 2-(3-isocyanatophenyl)-4,4,5,5-tetramethyl-[1,3,2]-dioxaborolane

Isomers (same molecular formula)

2-(4-isocyanatophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane C₁₃H₁₆BNO₃

7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3-benzoxazole C₁₃H₁₆BNO₃

2-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)-6-methoxybenzonitrile C₁₃H₁₆BNO₃

2-hydroxy-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile C₁₃H₁₆BNO₃

6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)furo[3,2-b]pyridine C₁₃H₁₆BNO₃

5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3-benzoxazole C₁₃H₁₆BNO₃