Structure Database (LMSD)
Common Name
ethyl decanoate
Systematic Name
ethyl decanoate
Synonyms
- WE(2:0/10:0)
No other lipid differing only in stereochemistry/bond geometry found
3D model of ethyl decanoate
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Classification
References
Comments
Pherobase Semiochemicals
String Representations
InChiKey (Click to copy)
RGXWDWUGBIJHDO-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C12H24O2/c1-3-5-6-7-8-9-10-11-12(13)14-4-2/h3-11H2,1-2H3
SMILES (Click to copy)
O=C(CCCCCCCCC)OCC
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
14
Rings
0
Aromatic Rings
0
Rotatable Bonds
10
Van der Waals Molecular Volume
231.10
Topological Polar Surface Area
26.30
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
2
logP
3.97
Molar Refractivity
59.73
Admin
Created at
-
Updated at
6th Jun 2022