CAS
1235099-38-3 Purity
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1235099-38-3 Purity
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Specification
The molecular formula is C7H4BF3KN.
The molecular weight is 209.02 g/mol.
The IUPAC name is potassium;(4-cyanophenyl)-trifluoroboranuide.
The InChI is InChI=1S/C7H4BF3N.K/c9-8(10,11)7-3-1-6(5-12)2-4-7;/h1-4H;/q-1;+1.
The InChIKey is JEQAKQWNUUSKHI-UHFFFAOYSA-N.
The canonical SMILES is [B-](C1=CC=C(C=C1)C#N)(F)(F)F.[K+].
The CAS number is 850623-36-8.
The European Community (EC) Number is 678-470-7.
Yes, Potassium (4-Cyanophenyl)trifluoroborate is a canonicalized compound.