Structure Database (LMSD)
Common Name
1,13-Tetradecadien-3-one
Systematic Name
1,13-Tetradecadien-3-one
Synonyms
No other lipid differing only in stereochemistry/bond geometry found
3D model of 1,13-Tetradecadien-3-one
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Main
Classification
String Representations
InChiKey (Click to copy)
XTFWXOWQURZTRR-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C14H26O/c1-3-5-6-7-8-9-10-11-12-13-14(15)4-2/h3H,1,4-13H2,2H3
SMILES (Click to copy)
CCC(=O)CCCCCCCCCC=C
References
Calculated Physicochemical Properties
Heavy Atoms
15
Rings
0
Aromatic Rings
0
Rotatable Bonds
11
Van der Waals Molecular Volume
254.27
Topological Polar Surface Area
17.07
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
1
logP
4.66
Molar Refractivity
67.05
Admin
Created at
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Updated at
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