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Specification
The molecular formula is C5H14ClNO2S.
The molecular weight is 187.69 g/mol.
The IUPAC name is 2-propan-2-ylsulfonylethanamine;hydrochloride.
InChI=1S/C5H13NO2S.ClH/c1-5(2)9(7,8)4-3-6;/h5H,3-4,6H2,1-2H3;1H
The InChIKey is DHFKENKHVSIOCO-UHFFFAOYSA-N.
There are 2 hydrogen bond donor counts.
The topological polar surface area is 68.5Ų.
There are 3 rotatable bond counts.
Yes, the compound is canonicalized.
The compound was created on 2011-03-28 and modified on 2023-11-25.