Butanedioic acid, 2-hydroxy-, compd. with 2-[(phenylmethyl)thio]ethanamine (1:1)
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![Butanedioic acid, 2-hydroxy-, compd. with 2-[(phenylmethyl)thio]ethanamine (1:1) structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/a9d08d4d19294194a3c3cb9bed856f61.png "Butanedioic acid, 2-hydroxy-, compd. with 2-[(phenylmethyl)thio]ethanamine (1:1)")
Butanedioic acid, 2-hydroxy-, compd. with 2-[(phenylmethyl)thio]ethanamine (1:1)
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CAS No:
22572-37-8
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Formula:
C9H13NS.C4H6O5
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Chemical Name:
Butanedioic acid, 2-hydroxy-, compd. with 2-[(phenylmethyl)thio]ethanamine (1:1)
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Synonyms:
Butanedioic acid,2-hydroxy-,compd. with 2-[(phenylmethyl)thio]ethanamine (1:1);Malic acid,compd. with 2-(benzylthio)ethylamine (1:1);Butanedioic acid,hydroxy-,compd. with 2-[(phenylmethyl)thio]ethanamine (1:1);Ethylamine,2-(benzylthio)-,malate (1:1);Ethanamine,2-[(phenylmethyl)thio]-,hydroxybutanedioate (1:1);S-Benzylcysteamine malate;Benzyl-2-thioethylammonium malate
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CAS No:
Butanedioic acid, 2-hydroxy-, compd. with 2-[(phenylmethyl)thio]ethanamine (1:1) Basic Attributes
301.35866
301.098394 g/mol
245-094-6
Computed Properties
Molecular Weight:301.36
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:7
Exact Mass:301.09839388
Monoisotopic Mass:301.09839388
Topological Polar Surface Area:146
Heavy Atom Count:20
Complexity:219
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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