4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile

CAS Registry Number®

171364-82-2

CAS Name

4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile

Molecular Formula

C13H16BNO2

Molecular Mass

229.08

Cite this Page

4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=171364-82-2 (retrieved 2024-11-22) (CAS RN: 171364-82-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    94-95 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C13H16BNO2/c1-12(2)13(3,4)17-14(16-12)11-7-5-10(9-15)6-8-11/h5-8H,1-4H3

InChIKey

InChIKey=HOPDTPGXBZCBNP-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

N#CC1=CC=C(C=C1)B2OC(C)(C)C(O2)(C)C

Other Names for this Substance

  • Benzonitrile, 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
  • 4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile
  • 2-(4-Cyanophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
  • 4,4,5,5-Tetramethyl-2-(4-cyanophenyl)-1,3,2-dioxaborolane
  • 4-(Cyanophenyl)boronic acid pinacol ester

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