Structure Database (LMSD)
Common Name
(S)-b-amino-isobutyric acid
Systematic Name
2S-methyl-3-amino-propanoic acid
Synonyms
3D model of (S)-b-amino-isobutyric acid
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Classification
Category
Main Class
Sub Class
String Representations
InChiKey (Click to copy)
QCHPKSFMDHPSNR-VKHMYHEASA-N
InChi (Click to copy)
InChI=1S/C4H9NO2/c1-3(2-5)4(6)7/h3H,2,5H2,1H3,(H,6,7)/t3-/m0/s1
SMILES (Click to copy)
C(=O)(O)[C@@H](C)CN
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
7
Rings
0
Aromatic Rings
0
Rotatable Bonds
2
Van der Waals Molecular Volume
103.70
Topological Polar Surface Area
63.32
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
2
logP
-0.05
Molar Refractivity
26.34
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Created at
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Updated at
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