Structure Database (LMSD)
Common Name
Ethyl 4-decenoate
Systematic Name
ethyl (4E)-dec-4-enoate
Synonyms
No other lipid differing only in stereochemistry/bond geometry found
3D model of Ethyl 4-decenoate
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)
AWNIQMQADACLCJ-CMDGGOBGSA-N
InChi (Click to copy)
InChI=1S/C12H22O2/c1-3-5-6-7-8-9-10-11-12(13)14-4-2/h8-9H,3-7,10-11H2,1-2H3/b9-8+
SMILES (Click to copy)
O(CC)C(CC/C=C/CCCCC)=O
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
14
Rings
0
Aromatic Rings
0
Rotatable Bonds
9
Van der Waals Molecular Volume
228.46
Topological Polar Surface Area
26.30
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
2
logP
3.75
Molar Refractivity
59.64
Admin
Created at
-
Updated at
6th Jun 2022