Structure Database (LMSD)
Common Name
Ethyl (2E,6Z)-dodecadienoate
Systematic Name
ethyl (2E,6Z)-dodeca-2,6-dienoate
Synonyms
3D model of Ethyl (2E,6Z)-dodecadienoate
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)
AASSLPGKTZCKLS-YILALFFRSA-N
InChi (Click to copy)
InChI=1S/C14H24O2/c1-3-5-6-7-8-9-10-11-12-13-14(15)16-4-2/h8-9,12-13H,3-7,10-11H2,1-2H3/b9-8-,13-12+
SMILES (Click to copy)
CCOC(=O)/C=C/CC/C=C\CCCCC
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
16
Rings
0
Aromatic Rings
0
Rotatable Bonds
10
Van der Waals Molecular Volume
260.42
Topological Polar Surface Area
26.30
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
2
logP
4.31
Molar Refractivity
68.78
Admin
Created at
-
Updated at
6th Jun 2022