1-methoxy-3-[4-(2-sulfosulfanylethylamino)butyl]benzene
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![1-methoxy-3-[4-(2-sulfosulfanylethylamino)butyl]benzene structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/a5ebb163949c48f2b7317a5a8e2a8d96.png "1-methoxy-3-[4-(2-sulfosulfanylethylamino)butyl]benzene")
1-methoxy-3-[4-(2-sulfosulfanylethylamino)butyl]benzene
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CAS No:
21224-55-5
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Formula:
C13H21NO4S2
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Chemical Name:
1-methoxy-3-[4-(2-sulfosulfanylethylamino)butyl]benzene
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Synonyms:
21224-55-5;2-((4-(m-Methoxyphenyl)butyl)amino)ethanethiol hydrogen sulfate (ester);s-(2-{[4-(3-methoxyphenyl)butyl]amino}ethyl) hydrogen sulfurothioate;1-methoxy-3-[4-(2-sulfosulfanylethylamino)butyl]benzene;S-2-((4-(m-Methoxyphenyl)butyl)amino)ethyl thiosulfate;DTXSID50943615;ZINC31570152;Ethanethiol, 2-(4-(m-methoxyphenyl)butyl)amino-, hydrogen sulfate (ester);S-(2-{[4-(3-methoxyphenyl)butyl]amino}ethyl) hydrogen thiosulfate
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CAS No:
1-methoxy-3-[4-(2-sulfosulfanylethylamino)butyl]benzene Basic Attributes
319.4 g/mol
319.09120050 g/mol
Computed Properties
Molecular Weight:319.4
XLogP3:-0.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:10
Exact Mass:319.09120050
Monoisotopic Mass:319.09120050
Topological Polar Surface Area:109
Heavy Atom Count:20
Complexity:343
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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