Structure Database (LMSD)
Common Name
3,6,8-dodecatrien-1-ol
Systematic Name
3,6,8-dodecatrien-1-ol
Synonyms
- dodeca-3,6,8-trien-1-ol
3D model of 3,6,8-dodecatrien-1-ol
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Classification
Reactions
Filter by species:
ⓘ
Reactions are shown if the E.C. number of the enzyme catalysing it is annotated in the UniProt database for a species belonging to the selected taxonomic class.
Click on an edge to display the reaction(s).
String Representations
InChiKey (Click to copy)
KWVQYNPBWXUHHT-ZYXMWXIMSA-N
InChi (Click to copy)
InChI=1S/C12H20O/c1-2-3-4-5-6-7-8-9-10-11-12-13/h4-7,9-10,13H,2-3,8,11-12H2,1H3/b5-4+,7-6+,10-9+
SMILES (Click to copy)
C(CC)/C=C/C=C/C/C=C/CCO
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
13
Rings
0
Aromatic Rings
0
Rotatable Bonds
7
Van der Waals Molecular Volume
217.03
Topological Polar Surface Area
20.23
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
1
logP
3.51
Molar Refractivity
59.14
Admin
Created at
-
Updated at
25th Apr 2022