(2R)-2-acetamido-3-(1-cyano-2-hydroxyethyl)sulfanylpropanoic acid
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(2R)-2-acetamido-3-(1-cyano-2-hydroxyethyl)sulfanylpropanoic acid
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CAS No:
116477-44-2
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Formula:
C8H12N2O4S
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Chemical Name:
(2R)-2-acetamido-3-(1-cyano-2-hydroxyethyl)sulfanylpropanoic acid
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Synonyms:
CHEMA;N-acetyl-S-(1-cyano-2-hydroxyethyl)cysteine;CHEMA;116477-44-2;(2R)-2-acetamido-3-(1-cyano-2-hydroxyethyl)sulfanylpropanoic acid;N-acetyl-S-(1-cyano-2-hydroxyethyl)-L-cysteine;N-Acetyl-S-(1-cyano-2-hydroxyethyl)cysteine;L-Cysteine, N-acetyl-S-(1-cyano-2-hydroxyethyl)-;DTXSID40922075;N-Acetyl-S-(2-hydroxy-1-cyanoethyl)cysteine;S-(1-Cyano-2-hydroxyethyl)-N-(1-hydroxyethylidene)cysteine
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CAS No:
(2R)-2-acetamido-3-(1-cyano-2-hydroxyethyl)sulfanylpropanoic acid Basic Attributes
232.26 g/mol
232.05177804 g/mol
Computed Properties
Molecular Weight:232.26
XLogP3:-1
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:232.05177804
Monoisotopic Mass:232.05177804
Topological Polar Surface Area:136
Heavy Atom Count:15
Complexity:286
Defined Atom Stereocenter Count:1
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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