CAS
312693-55-3 Purity
96%
312693-55-3 Purity
96%
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Specification
The molecular formula is C9H6F2O2.
The molecular weight is 184.14 g/mol.
The IUPAC name is (E)-3-(3,5-difluorophenyl)prop-2-enoic acid.
The InChI is InChI=1S/C9H6F2O2/c10-7-3-6(1-2-9(12)13)4-8(11)5-7/h1-5H,(H,12,13)/b2-1+.
The InChIKey is MBAWRXICVNIUGY-OWOJBTEDSA-N.
The canonical SMILES is C1=C(C=C(C=C1F)F)C=CC(=O)O.
The synonyms are 3,5-Difluorocinnamic acid and trans-3,5-Difluorocinnamic acid.
The CAS number is 84315-23-1.
Yes, trans-3,5-Difluorocinnamic acid is a covalently-bonded unit.