Structure Database (LMSD)
Common Name
alpha-hydroxy-isobutyric acid
Systematic Name
2-hydroxy-2-methyl-propanoic acid
Synonyms
- Acetonic acid
3D model of alpha-hydroxy-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)
BWLBGMIXKSTLSX-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C4H8O3/c1-4(2,7)3(5)6/h7H,1-2H3,(H,5,6)
SMILES (Click to copy)
C(=O)(O)C(O)(C)C
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
7
Rings
0
Aromatic Rings
0
Rotatable Bonds
1
Van der Waals Molecular Volume
101.49
Topological Polar Surface Area
57.53
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
3
logP
0.13
Molar Refractivity
24.45
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Created at
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Updated at
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