Structure Database (LMSD)
Common Name
8-hydroxy caprylic acid
Systematic Name
8-hydroxy-octanoic acid
Synonyms
No other lipid differing only in stereochemistry/bond geometry found
3D model of 8-hydroxy caprylic 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)
KDMSVYIHKLZKET-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C8H16O3/c9-7-5-3-1-2-4-6-8(10)11/h9H,1-7H2,(H,10,11)
SMILES (Click to copy)
C(CCCCCO)CC(=O)O
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
11
Rings
0
Aromatic Rings
0
Rotatable Bonds
7
Van der Waals Molecular Volume
170.69
Topological Polar Surface Area
57.53
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
3
logP
1.69
Molar Refractivity
42.91
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Created at
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Updated at
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