CAS
1166827-91-3 Purity
97%
1166827-91-3 Purity
97%
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Specification
The molecular formula is C6H3F3N2O.
The molecular weight is 176.10 g/mol.
It was created on 2007-12-05 and last modified on 2023-12-30.
The IUPAC name is 5-(trifluoromethyl)pyrazine-2-carbaldehyde.
The InChI is InChI=1S/C6H3F3N2O/c7-6(8,9)5-2-10-4(3-12)1-11-5/h1-3H.
The InChIKey is AIMGDDYGZCDYNK-UHFFFAOYSA-N.
It has 0 hydrogen bond donor counts.
The topological polar surface area is 42.8 Ų.
There are 12 heavy atoms present.
Yes, it is a canonicalized compound.