3-[3-(dimethylamino)propyl-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexylsulfonyl)amino]-2-hydroxypropane-1-sulfonic acid
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![3-[3-(dimethylamino)propyl-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexylsulfonyl)amino]-2-hydroxypropane-1-sulfonic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/95dd8ea01a3549db9268a9b604d8c74a.png "3-[3-(dimethylamino)propyl-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexylsulfonyl)amino]-2-hydroxypropane-1-sulfonic acid")
3-[3-(dimethylamino)propyl-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexylsulfonyl)amino]-2-hydroxypropane-1-sulfonic acid
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CAS No:
788772-31-6
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Formula:
C14H19F13N2O6S2
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Chemical Name:
3-[3-(dimethylamino)propyl-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexylsulfonyl)amino]-2-hydroxypropane-1-sulfonic acid
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Synonyms:
DTXSID00860964;3-{[3-(Dimethylamino)propyl](1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexane-1-sulfonyl)amino}-2-hydroxypropane-1-sulfonic acid;788772-31-6
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CAS No:
3-[3-(dimethylamino)propyl-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexylsulfonyl)amino]-2-hydroxypropane-1-sulfonic acid Basic Attributes
622.4 g/mol
622.0476948 g/mol
Computed Properties
Molecular Weight:622.4
XLogP3:0.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:21
Rotatable Bond Count:14
Exact Mass:622.0476948
Monoisotopic Mass:622.0476948
Topological Polar Surface Area:132
Heavy Atom Count:37
Complexity:989
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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