(2S)-2-(2-hydroxyethylamino)-3-methylbutanoic acid
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(2S)-2-(2-hydroxyethylamino)-3-methylbutanoic acid
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CAS No:
101769-73-7
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Formula:
C7H15NO3
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Chemical Name:
(2S)-2-(2-hydroxyethylamino)-3-methylbutanoic acid
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Synonyms:
2-hydroxyethylvaline;2-hydroxyethylvaline, (L)-isomer;N-(2-hydroxyethyl)valine;101769-73-7;L-Valine, N-(2-hydroxyethyl)-;N-2-(Hydroxyethyl)-L-valine;N-(2-Hydroxyethyl)valine;hydroxyethylvaline;(2S)-2-(2-hydroxyethylamino)-3-methylbutanoic acid;N-(2-Hydroxyethyl)-L-valine;SCHEMBL3294010;DTXSID40906618;ZINC5761066;(2S)-2-(2-hydroxyethylazaniumyl)-3-methylbutanoate
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CAS No:
Computed Properties
Molecular Weight:161.20
XLogP3:-2.2
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:161.10519334
Monoisotopic Mass:161.10519334
Topological Polar Surface Area:69.6
Heavy Atom Count:11
Complexity:125
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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