Structure Database (LMSD)
Common Name
xi-5-Hydroxydodecanoic acid
Systematic Name
5-hydroxydodecanoic acid
Synonyms
3D model of xi-5-Hydroxydodecanoic 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)
LXNOENXQFNYMGT-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C12H24O3/c1-2-3-4-5-6-8-11(13)9-7-10-12(14)15/h11,13H,2-10H2,1H3,(H,14,15)
SMILES (Click to copy)
OC(=O)CCCC(CCCCCCC)O
References
Calculated Physicochemical Properties
Heavy Atoms
15
Rings
0
Aromatic Rings
0
Rotatable Bonds
10
Van der Waals Molecular Volume
239.89
Topological Polar Surface Area
57.53
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
3
logP
3.25
Molar Refractivity
61.38
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Created at
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Updated at
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