(S)-Methyl 2-(3,3-dimethylbutylamino)-3,3-dimethylbutanoate
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(S)-Methyl 2-(3,3-dimethylbutylamino)-3,3-dimethylbutanoate
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CAS No:
1052703-81-7
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Formula:
C13H27NO2
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Chemical Name:
(S)-Methyl 2-(3,3-dimethylbutylamino)-3,3-dimethylbutanoate
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Synonyms:
(S)-Methyl 2-(3,3-dimethylbutylamino)-3,3-dimethylbutanoate;N-(3,3-Dimethylbutyl)-3-methyl-L-valine methyl ester;methyl (2S)-2-(3,3-dimethylbutylamino)-3,3-dimethylbutanoate
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CAS No:
(S)-Methyl 2-(3,3-dimethylbutylamino)-3,3-dimethylbutanoate Basic Attributes
229.35898
229.20400
DTXSID50718002
2922499990
Computed Properties
Molecular Weight:229.36
XLogP3:3.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:7
Exact Mass:229.204179104
Monoisotopic Mass:229.204179104
Topological Polar Surface Area:38.3
Heavy Atom Count:16
Complexity:223
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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(S)-Methyl 2-(3,3-dimethylbutylamino)-3,3-dimethylbutanoate
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