α,α-Dimethyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzeneacetonitrile

CAS Registry Number®

1082066-30-5

CAS Name

α,α-Dimethyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzeneacetonitrile

Molecular Formula

C16H22BNO2

Molecular Mass

271.16

Cite this Page

α,α-Dimethyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzeneacetonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1082066-30-5 (retrieved 2024-10-05) (CAS RN: 1082066-30-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C16H22BNO2/c1-14(2,11-18)12-7-9-13(10-8-12)17-19-15(3,4)16(5,6)20-17/h7-10H,1-6H3

InChIKey

InChIKey=XJOJSFBFKRCJTK-UHFFFAOYSA-N

SMILES

CC1(C)OB(OC1(C)C)C2=CC=C(C(C#N)(C)C)C=C2

Canonical SMILES

N#CC(C1=CC=C(C=C1)B2OC(C)(C)C(O2)(C)C)(C)C

Other Names for this Substance

  • Benzeneacetonitrile, α,α-dimethyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
  • α,α-Dimethyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzeneacetonitrile
  • 2-Methyl-2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]propanenitrile
  • 2-Methyl-2-[4-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]propanenitrile

CAS INSIGHTSTM
© Nobel Prize Outreach. Photo: Hugh Fox