methyl 2-amino-3-methyl-3-sulfanylbutanoate
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methyl 2-amino-3-methyl-3-sulfanylbutanoate
structure -
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CAS No:
90128-96-4
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Formula:
C6H13NO2S
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Chemical Name:
methyl 2-amino-3-methyl-3-sulfanylbutanoate
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Synonyms:
90128-96-4;ACMC-20n5mx;methyl 2-amino-3-methyl-3-sulfanylbutanoate;SCHEMBL2420558;L-Valine, 3-mercapto-,methyl ester;NSC401061;NSC-401061;DS-000775;methyl 2-amino-3-methyl-3-sulfanyl-butanoate;Methyl (2R)-2-Amino-3-Methyl-3-Sulfanyl-Butanoate;149207-23-8
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CAS No:
Computed Properties
Molecular Weight:163.24
XLogP3:0.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:163.06669983
Monoisotopic Mass:163.06669983
Topological Polar Surface Area:53.3
Heavy Atom Count:10
Complexity:136
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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