Structure Database (LMSD)
Common Name
4-hydroxy-undecanoic acid
Systematic Name
4-hydroxy-undecanoic acid
Synonyms
3D model of 4-hydroxy-undecanoic 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)
XEXIVNNTJNBUGV-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C11H22O3/c1-2-3-4-5-6-7-10(12)8-9-11(13)14/h10,12H,2-9H2,1H3,(H,13,14)
SMILES (Click to copy)
C(CCC(O)CCCCCCC)(=O)O
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
14
Rings
0
Aromatic Rings
0
Rotatable Bonds
9
Van der Waals Molecular Volume
222.59
Topological Polar Surface Area
57.53
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
3
logP
2.86
Molar Refractivity
56.76
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Created at
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Updated at
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