CAS
931105-53-2 Purity
96%
931105-53-2 Purity
96%
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Specification
The molecular formula is C7H5FO.
The PubChem CID is 57420199.
The molecular weight is 128.14 g/mol.
The IUPAC name is 2,3,5,6-tetradeuterio-4-fluorobenzaldehyde.
The InChI is InChI=1S/C7H5FO/c8-7-3-1-6(5-9)2-4-7/h1-5H/i1D,2D,3D,4D.
The InChIKey is UOQXIWFBQSVDPP-RHQRLBAQSA-N.
The canonical SMILES is C1=CC(=CC=C1C=O)F.
The XLogP3 value is 1.6.
It has 0 hydrogen bond donor counts.
It has 2 hydrogen bond acceptor counts.