91257-14-6 Purity
96%
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Specification
The molecular formula of 2-Formylbenzenesulfonic acid is C7H6O4S.
The molecular weight of 2-Formylbenzenesulfonic acid is 186.19 g/mol.
The IUPAC name of 2-Formylbenzenesulfonic acid is 2-formylbenzenesulfonic acid.
The InChI of 2-Formylbenzenesulfonic acid is InChI=1S/C7H6O4S/c8-5-6-3-1-2-4-7(6)12(9,10)11/h1-5H,(H,9,10,11).
The InChIKey of 2-Formylbenzenesulfonic acid is SHHKMWMIKILKQW-UHFFFAOYSA-N.
The canonical SMILES of 2-Formylbenzenesulfonic acid is C1=CC=C(C(=C1)C=O)S(=O)(=O)O.
The CAS number of 2-Formylbenzenesulfonic acid is 91-25-8.
2-Formylbenzenesulfonic acid has 1 hydrogen bond donor count.
2-Formylbenzenesulfonic acid has 4 hydrogen bond acceptor counts.
The topological polar surface area of 2-Formylbenzenesulfonic acid is 79.8?2.