1-chloro-4-[1-(2-sulfosulfanylethylamino)butan-2-yl]benzene
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![1-chloro-4-[1-(2-sulfosulfanylethylamino)butan-2-yl]benzene structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/3036e984f047445f922d6f410559f50b.png "1-chloro-4-[1-(2-sulfosulfanylethylamino)butan-2-yl]benzene")
1-chloro-4-[1-(2-sulfosulfanylethylamino)butan-2-yl]benzene
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CAS No:
21224-50-0
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Formula:
C12H18ClNO3S2
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Chemical Name:
1-chloro-4-[1-(2-sulfosulfanylethylamino)butan-2-yl]benzene
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Synonyms:
21224-50-0;1-chloro-4-[1-(2-sulfosulfanylethylamino)butan-2-yl]benzene;2-((2-(p-Chlorophenyl)butyl)amino)ethanethiol hydrogen sulfate (ester);s-(2-{[2-(4-chlorophenyl)butyl]amino}ethyl) hydrogen sulfurothioate;S-2-((2-(p-Chlorophenyl)butyl)amino)ethyl thiosulfate;DTXSID10943611;Ethanethiol, 2-((2-(p-chlorophenyl)butyl)amino)-, hydrogen sulfate (ester);2-[[2-(p-Chlorophenyl)butyl]amino]ethanethiol sulfate
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CAS No:
1-chloro-4-[1-(2-sulfosulfanylethylamino)butan-2-yl]benzene Basic Attributes
323.9 g/mol
323.0416635 g/mol
Computed Properties
Molecular Weight:323.9
XLogP3:0.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:8
Exact Mass:323.0416635
Monoisotopic Mass:323.0416635
Topological Polar Surface Area:100
Heavy Atom Count:19
Complexity:337
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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