CAS
911825-61-1 Purity
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911825-61-1 Purity
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Specification
The molecular formula is C7H6FIO.
The molecular weight is 252.02 g/mol.
The IUPAC name is (2-fluoro-6-iodophenyl)methanol.
The InChI is InChI=1S/C7H6FIO/c8-6-2-1-3-7(9)5(6)4-10/h1-3,10H,4H2.
The InChIKey is ZMLMVTDRUORFDB-UHFFFAOYSA-N.
The canonical SMILES is C1=CC(=C(C(=C1)I)CO)F.
The CAS number is 911825-94-0.
The XLogP3-AA value is 1.8.
The hydrogen bond donor count is 1.
Yes, the compound is canonicalized.