Structure Database (LMSD)
Common Name
Propyl 2,4-decadienoate
Systematic Name
propyl (2E,4E)-deca-2,4-dienoate
Synonyms
No other lipid differing only in stereochemistry/bond geometry found
3D model of Propyl 2,4-decadienoate
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)
RKDOXCGYGLYOBV-BNFZFUHLSA-N
InChi (Click to copy)
InChI=1S/C13H22O2/c1-3-5-6-7-8-9-10-11-13(14)15-12-4-2/h8-11H,3-7,12H2,1-2H3/b9-8+,11-10+
SMILES (Click to copy)
O(CCC)C(/C=C/C=C/CCCCC)=O
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
15
Rings
0
Aromatic Rings
0
Rotatable Bonds
9
Van der Waals Molecular Volume
243.12
Topological Polar Surface Area
26.30
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
2
logP
3.92
Molar Refractivity
64.16
Admin
Created at
-
Updated at
6th Jun 2022