CAS
60463-12-9 Purity
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60463-12-9 Purity
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Specification
The molecular formula is C8H4FN3.
The molecular weight is 161.14 g/mol.
The IUPAC name is 5-fluoro-1H-pyrrolo[2,3-b]pyridine-4-carbonitrile.
The InChI is InChI=1S/C8H4FN3/c9-7-4-12-8-5(1-2-11-8)6(7)3-10/h1-2,4H,(H,11,12).
The InChIKey is OUAZJINPTDHOAR-UHFFFAOYSA-N.
The Canonical SMILES is C1=CNC2=NC=C(C(=C21)C#N)F.
The CAS number is 1015610-15-7.
The XLogP3-AA value is 1.1.
Yes, it is considered as a canonicalized compound.