CAS
824429-54-1 Purity
96%
824429-54-1 Purity
96%
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Specification
The molecular formula is C14H6F17N.
It was created on 2011-12-04 and last modified on 2023-11-25.
The IUPAC Name is N-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)aniline.
The InChIKey is DXHQCBHTNBRZJT-UHFFFAOYSA-N.
The Canonical SMILES is C1=CC=C(C=C1)NC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F.
The molecular weight is 511.18 g/mol.
It has 1 hydrogen bond donor count.
The XLogP3-AA value is 7.8.
The heavy atom count is 32.
Yes, the compound is canonicalized.