CAS
912770-99-1 Purity
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912770-99-1 Purity
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Specification
The molecular formula is C13H13FN2O.
It was created on 2007-10-02 and modified on 2023-12-30.
The IUPAC name is N-(1-cyanocyclopentyl)-2-fluorobenzamide.
The InChI is InChI=1S/C13H13FN2O/c14-11-6-2-1-5-10(11)12(17)16-13(9-15)7-3-4-8-13/h1-2,5-6H,3-4,7-8H2,(H,16,17).
The molecular weight is 232.25 g/mol.
It has 1 hydrogen bond donor count.
The topological polar surface area is 52.9 Ų.
It has 2 rotatable bond counts.
Yes, it is a canonicalized compound.
The XLogP3-AA value is 2.1.