Structure Database (LMSD)
Common Name
12-hydroxy-3Z,6Z-dodecadienoic acid
Systematic Name
12-hydroxy-3Z,6Z-dodecadienoic acid
Synonyms
3D model of 12-hydroxy-3Z,6Z-dodecadienoic 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)
BSWDOBLGMLCOJP-NGNAIVRQSA-N
InChi (Click to copy)
InChI=1S/C12H20O3/c13-11-9-7-5-3-1-2-4-6-8-10-12(14)15/h1-2,6,8,13H,3-5,7,9-11H2,(H,14,15)/b2-1-,8-6-
SMILES (Click to copy)
C(C/C=C\C/C=C\CCCCCO)(=O)O
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
15
Rings
0
Aromatic Rings
0
Rotatable Bonds
9
Van der Waals Molecular Volume
234.61
Topological Polar Surface Area
57.53
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
3
logP
2.80
Molar Refractivity
61.19
Admin
Created at
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Updated at
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