(2S)-N-(2-hydroxysulfonothioyloxyethyl)-1-(4-methoxyphenyl)butan-2-amine
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(2S)-N-(2-hydroxysulfonothioyloxyethyl)-1-(4-methoxyphenyl)butan-2-amine
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CAS No:
38914-79-3
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Formula:
C13H21NO4S2
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Chemical Name:
(2S)-N-(2-hydroxysulfonothioyloxyethyl)-1-(4-methoxyphenyl)butan-2-amine
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Synonyms:
38914-79-3;BRN 2992938;DTXSID30959698;S-2-((1-(p-Methoxybenzyl)propyl)amino)ethyl hydrogen thiosulfate;Ethanethiol, 2-(1-(p-methoxybenzyl)propyl)amino-, hydrogen thiosulfate;O-(2-{[1-(4-Methoxyphenyl)butan-2-yl]amino}ethyl) hydrogen sulfurothioate
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CAS No:
(2S)-N-(2-hydroxysulfonothioyloxyethyl)-1-(4-methoxyphenyl)butan-2-amine Basic Attributes
319.4 g/mol
319.09120050 g/mol
Computed Properties
Molecular Weight:319.4
XLogP3:3.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:9
Exact Mass:319.09120050
Monoisotopic Mass:319.09120050
Topological Polar Surface Area:108
Heavy Atom Count:20
Complexity:363
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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