Structure Database (LMSD)
Common Name
2S-acetyl-2-hydroxy-butanoic acid
Systematic Name
2S-ethyl-2-hydroxy-3-oxobutanoic acid
Synonyms
3D model of 2S-acetyl-2-hydroxy-butanoic 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)
VUQLHQFKACOHNZ-LURJTMIESA-N
InChi (Click to copy)
InChI=1S/C6H10O4/c1-3-6(10,4(2)7)5(8)9/h10H,3H2,1-2H3,(H,8,9)/t6-/m0/s1
SMILES (Click to copy)
C(=O)(O)[C@](C(C)=O)(O)CC
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
10
Rings
0
Aromatic Rings
0
Rotatable Bonds
3
Van der Waals Molecular Volume
142.24
Topological Polar Surface Area
74.60
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
4
logP
0.09
Molar Refractivity
34.07
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Created at
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Updated at
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