Structure Database (LMSD)
Common Name
2S-hydroxyadipic acid
Systematic Name
2S-hydroxy-Hexanedioic acid
Synonyms
3D model of 2S-hydroxyadipic acid
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Main
Classification
Category
Main Class
Sub Class
String Representations
InChiKey (Click to copy)
OTTXIFWBPRRYOG-BYPYZUCNSA-N
InChi (Click to copy)
InChI=1S/C6H10O5/c7-4(6(10)11)2-1-3-5(8)9/h4,7H,1-3H2,(H,8,9)(H,10,11)/t4-/m0/s1
SMILES (Click to copy)
C([C@@H](O)CCCC(=O)O)(=O)O
References
Calculated Physicochemical Properties
Heavy Atoms
11
Rings
0
Aromatic Rings
0
Rotatable Bonds
5
Van der Waals Molecular Volume
151.03
Topological Polar Surface Area
94.83
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
5
logP
-0.03
Molar Refractivity
35.64
Admin
Created at
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Updated at
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