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4-bromanylbenzenecarbonitrile; [4-(trifluoromethyl)phenyl]boronic acid

4-bromanylbenzenecarbonitrile; [4-(trifluoromethyl)phenyl]boronic acid

Systemtic Name:4-bromanylbenzenecarbonitrile; [4-(trifluoromethyl)phenyl]boronic acid
Openeye Name:4-bromobenzonitrile; [4-(trifluoromethyl)phenyl]boronic acid
CAS Name:4-bromobenzonitrile; [4-(trifluoromethyl)phenyl]boronic acid
IUPAC Name:4-bromobenzonitrile; [4-(trifluoromethyl)phenyl]boronic acid
Traditional Name:4-bromobenzonitrile; [4-(trifluoromethyl)phenyl]boronic acid
Formula: C14H10BBrF3NO2
MolecularWeight: 371.94491
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Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC=C(C=C1)C(F)(F)F)(O)O.C1=CC(=CC=C1C#N)Br


Isomeric SMILES

B(C1=CC=C(C=C1)C(F)(F)F)(O)O.C1=CC(=CC=C1C#N)Br


InChI

InChI=1S/C7H6BF3O2.C7H4BrN/c9-7(10,11)5-1-3-6(4-2-5)8(12)13;8-7-3-1-6(5-9)2-4-7/h1-4,12-13H;1-4H


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