81-60-7 Purity
96%
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Specification
The molecular formula of the keyword is C12H18NNaO4S.
The molecular weight of the keyword is 295.33 g/mol.
The synonyms of the keyword are 82692-93-1, TOOS, 3-(N-Ethyl-3-methylanilino)-2-hydroxypropanesulfonic acid sodium salt, TOOS sodium salt, and Sodium 3-(ethyl(m-tolyl)amino)-2-hydroxypropane-1-sulfonate.
The IUPAC name of the keyword is sodium;3-(N-ethyl-3-methylanilino)-2-hydroxypropane-1-sulfonate.
The InChIkey of the keyword is IRQRBVOQGUPTLG-UHFFFAOYSA-M.
The Canonical SMILES of the keyword is CCN(CC(CS(=O)(=O)[O-])O)C1=CC=CC(=C1)C.[Na+].
The CAS number of the keyword is 82692-93-1.
The European Community (EC) number of the keyword is 617-377-8.
The hydrogen bond donor count of the keyword is 1.
The hydrogen bond acceptor count of the keyword is 5.