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CAS Number: 463335-96-8
4-fluoro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile

Structure

4-fluoro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile
Name: 4-fluoro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile
Synonyms:
General Information
Product Number: 463335968

CAS Registry Number 463335-96-8
Name:
Benzonitrile, 4-​fluoro-​2-​(4,​4,​5,​5-​tetramethyl-​1,​3,​2-​dioxaborolan-​2-​yl)​-
4-Fluoro-2-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)benzonitrile

 

Chemical Formula: C13H15BFNO2
Exact Mass: 247.12
Molecular Weight: 247.07
m/z: 247.12 (100.0%), 246.12 (24.0%), 248.12 (14.2%), 249.12 (1.3%)

 

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

InChI Key:ZULLJYIMHRJPQA-UHFFFAOYSA-N

Canonical SMILES:B1(OC(C(O1)(C)C)(C)C)C2=C(C=CC(=C2)F)C#N

Specification

98%

References
  1. (1) Chotana, Ghayoor A.; Journal of the American Chemical Society 2005, V127(30), P10539-10544 CAPLUS
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