5031-78-7 Purity
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Specification
The molecular formula is C7H12NNaO4S.
The molecular weight is 229.23 g/mol.
The IUPAC name is sodium;2-methyl-2-(prop-2-enoylamino)propane-1-sulfonate.
The InChI is InChI=1S/C7H13NO4S.Na/c1-4-6(9)8-7(2,3)5-13(10,11)12;/h4H,1,5H2,2-3H3,(H,8,9)(H,10,11,12);/q;+1/p-1.
The InChIKey is FWFUWXVFYKCSQA-UHFFFAOYSA-.
The canonical SMILES is CC(C)(CS(=O)(=O)[O-])NC(=O)C=C.[Na+].
The CAS number is 5165-97-9.
The European Community (EC) Number is 225-948-4.
The UNII is 2T9Q6EKI0G.
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