CAS
948014-25-3 Purity
96%
948014-25-3 Purity
96%
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Specification
The molecular formula is C6H4ClFN2O2.
The molecular weight is 190.56 g/mol.
It was created on 2010-03-29.
The IUPAC name is 2-chloro-3-fluoro-6-nitroaniline.
The InChIKey is BIYFBTINNKCDBR-UHFFFAOYSA-N.
The Canonical SMILES is C1=CC(=C(C(=C1[N+](=O)[O-])N)Cl)F.
The XLogP3-AA value is 2.3.
There is 1 hydrogen bond donor count.
The topological polar surface area is 71.8 Ų.
Yes, it is considered a canonicalized compound according to PubChem.