CAS
480-43-3 Purity
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480-43-3 Purity
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Specification
The molecular formula is C8H8O4.
The molecular weight is 168.15 g/mol.
The IUPAC name is 1-(2,4,6-trihydroxyphenyl)ethanone.
The InChI key is XLEYFDVVXLMULC-UHFFFAOYSA-N.
The canonical SMILES is CC(=O)C1=C(C=C(C=C1O)O)O.
The CAS number is 480-66-0.
The EC number is 207-556-5.
There are 3 hydrogen bond donor counts.
There are 4 hydrogen bond acceptor counts.
The topological polar surface area is 77.8 ?2.