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

CAS Registry Number®

1035235-29-0

CAS Name

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

Molecular Formula

C13H15BFNO2

Molecular Mass

247.07

Cite this Page

3-Fluoro-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=1035235-29-0 (retrieved 2024-11-21) (CAS RN: 1035235-29-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H15BFNO2/c1-12(2)13(3,4)18-14(17-12)10-6-5-9(8-16)7-11(10)15/h5-7H,1-4H3

InChIKey

InChIKey=FEUINZSEHIJUBU-UHFFFAOYSA-N

SMILES

FC1=C(B2OC(C)(C)C(C)(C)O2)C=CC(C#N)=C1

Canonical SMILES

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

Other Names for this Substance

  • Benzonitrile, 3-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
  • 3-Fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile
  • 4-Cyano-2-fluoro-phenylboronic acid pinacol ester

CAS INSIGHTSTM
Targeted protein degrader structure, illustration