(2S)-2-[(3,3-dimethyl-4H-isoquinolin-1-yl)amino]propanoic acid
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![(2S)-2-[(3,3-dimethyl-4H-isoquinolin-1-yl)amino]propanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/007119123530467cbbd2f8b2f31924d4.png "(2S)-2-[(3,3-dimethyl-4H-isoquinolin-1-yl)amino]propanoic acid")
(2S)-2-[(3,3-dimethyl-4H-isoquinolin-1-yl)amino]propanoic acid
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CAS No:
187884-90-8
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Formula:
C14H18N2O2
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Chemical Name:
(2S)-2-[(3,3-dimethyl-4H-isoquinolin-1-yl)amino]propanoic acid
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CAS No:
(2S)-2-[(3,3-dimethyl-4H-isoquinolin-1-yl)amino]propanoic acid Basic Attributes
246.30500
246.136827821
DTXSID60172111
Computed Properties
Molecular Weight:246.30
XLogP3:2.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:246.136827821
Monoisotopic Mass:246.136827821
Topological Polar Surface Area:61.7
Heavy Atom Count:18
Complexity:363
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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