89-99-6 Purity
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Specification
The molecular formula of 3-Chloro-2-fluorobenzonitrile is C7H3ClFN.
The molecular weight of 3-Chloro-2-fluorobenzonitrile is 155.55 g/mol.
Some synonyms for 3-Chloro-2-fluorobenzonitrile include 2-fluoro-3-chlorobenzonitrile and QR862S6CEL.
The IUPAC name of 3-Chloro-2-fluorobenzonitrile is 3-chloro-2-fluorobenzonitrile.
The InChI code for 3-Chloro-2-fluorobenzonitrile is CHKLNKWJIDQKFV-UHFFFAOYSA-N.
The Canonical SMILES representation of 3-Chloro-2-fluorobenzonitrile is C1=CC(=C(C(=C1)Cl)F)C#N.
The CAS number for 3-Chloro-2-fluorobenzonitrile is 94087-40-8.
3-Chloro-2-fluorobenzonitrile has 2 hydrogen bond acceptor counts.
The XLogP3-AA value for 3-Chloro-2-fluorobenzonitrile is 2.4.
Yes, 3-Chloro-2-fluorobenzonitrile is a canonicalized compound.