4-(5,5-Dimethyl-1,3,2-dioxaborinan-2-yl)-3-methyl-benzonitrile, ≥95%, ≥95%

cas: 2231089-47-5 — see every product listed under this CAS number, including other names

4-(5,5-Dimethyl-1,3,2-dioxaborinan-2-yl)-3-methyl-benzonitrile, ≥95%, ≥95% (CAS 2231089-47-5) is a chemical reagent available from Chemat. Available pack sizes: 1g. Offered by: Chemat.

• 2D
• 3D

4-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)-3-methylbenzonitrile (CAS 2231089-47-5) is a chemical compound with the molecular formula C13H16BNO2 and a molecular weight of 229.08 g/mol. IUPAC name: 4-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)-3-methylbenzonitrile. InChIKey: IFFCVEBPGJRPOC-UHFFFAOYSA-N.

Identity

Molecular formula	C13H16BNO2
Molecular weight	229.08 g/mol
IUPAC name	4-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)-3-methylbenzonitrile
InChIKey	IFFCVEBPGJRPOC-UHFFFAOYSA-N
SMILES	B1(OCC(CO1)(C)C)C2=C(C=C(C=C2)C#N)C

Computed by PubChem (NCBI)

Synonyms: 4-(5,5-Dimethyl-1,3,2-dioxaborinan-2-yl)-3-methyl-benzonitrile, 4-(5,5-Dimethyl-1,3,2-dioxaborinan-2-yl)-3-methylbenzonitrile

Isomers (same molecular formula)

3-(4,4,6-trimethyl-1,3,2-dioxaborinan-2-yl)benzonitrile C₁₃H₁₆BNO₂

4-(4,4,6-trimethyl-1,3,2-dioxaborinan-2-yl)benzonitrile C₁₃H₁₆BNO₂

2-[4-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)phenyl]acetonitrile C₁₃H₁₆BNO₂

2-(4-isocyanophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane C₁₃H₁₆BNO₂