CAS
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Specification
The molecular formula is C10H18N2O6S.
The molecular weight is 294.33 g/mol.
The IUPAC name is 2-[4-amino-N-(2-hydroxyethyl)anilino]ethanol;sulfuric acid.
The InChI is InChI=1S/C10H16N2O2.H2O4S/c11-9-1-3-10(4-2-9)12(5-7-13)6-8-14;1-5(2,3)4/h1-4,13-14H,5-8,11H2;(H2,1,2,3,4).
The InChIKey is KMCFMEHSEWDYKG-UHFFFAOYSA-N.
The canonical SMILES is C1=CC(=CC=C1N)N(CCO)CCO.OS(=O)(=O)O.
The CAS number is 54381-16-7.
It has 5 hydrogen bond donor counts.
It has 8 hydrogen bond acceptor counts.