3-(5,5-Dimethyl-1,3,2-dioxaborinan-2-yl)benzonitrile

CAS Registry Number®

214360-45-9
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CAS Name

3-(5,5-Dimethyl-1,3,2-dioxaborinan-2-yl)benzonitrile

Molecular Formula

C12H14BNO2

Molecular Mass

215.06

Cite this Page

3-(5,5-Dimethyl-1,3,2-dioxaborinan-2-yl)benzonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=214360-45-9 (retrieved 2024-05-02) (CAS RN: 214360-45-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C12H14BNO2/c1-12(2)8-15-13(16-9-12)11-5-3-4-10(6-11)7-14/h3-6H,8-9H2,1-2H3

InChIKey

InChIKey=RTYUBKQTFNAFQC-UHFFFAOYSA-N

SMILES

C(#N)C=1C=C(B2OCC(C)(C)CO2)C=CC1

Canonical SMILES

N#CC1=CC=CC(=C1)B2OCC(C)(C)CO2

Other Names for this Substance

  • Benzonitrile, 3-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)-
  • 3-(5,5-Dimethyl-1,3,2-dioxaborinan-2-yl)benzonitrile
  • 2,2-Dimethyltrimethylene (3-cyanophenyl)boronate

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