4-(2-sulfosulfanylethylamino)butylcycloheptane
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4-(2-sulfosulfanylethylamino)butylcycloheptane
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CAS No:
21209-06-3
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Formula:
C13H27NO3S2
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Chemical Name:
4-(2-sulfosulfanylethylamino)butylcycloheptane
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Synonyms:
21209-06-3;BRN 2981727;s-{2-[(4-cycloheptylbutyl)amino]ethyl} hydrogen sulfurothioate;S-2-((4-Cycloheptylbutyl)amino)ethyl thiosulfate;DTXSID60943560;2-((4-Cycloheptylbutyl)amino)ethanethiol hydrogen sulfate (ester);Thiosulfuric acid, S-(2-((4-cycloheptylbutyl)amino)ethyl) ester;Ethanethiol, 2-(4-cycloheptylbutyl)amino-, hydrogen sulfate (ester);ZINC31569907;2-(4-Cycloheptylbutyl)aminoethanethiol sulfate
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CAS No:
Computed Properties
Molecular Weight:309.5
XLogP3:1.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:9
Exact Mass:309.14323607
Monoisotopic Mass:309.14323607
Topological Polar Surface Area:100
Heavy Atom Count:19
Complexity:306
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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