CAS
92268-40-1 Purity
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92268-40-1 Purity
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The molecular formula is C7H9F2N.
The molecular weight is 145.15 g/mol.
The IUPAC name is 4,4-difluorocyclohexane-1-carbonitrile.
The InChI is InChI=1S/C7H9F2N/c8-7(9)3-1-6(5-10)2-4-7/h6H,1-4H2.
The InChIKey is IZGJQRIMRGAMTH-UHFFFAOYSA-N.
It has 3 hydrogen bond acceptor counts.
The topological polar surface area is 23.8 Ų.
The exact mass is 145.07030562 g/mol.
It has 0 rotatable bond counts.
Yes, the compound is canonicalized.