Structure Database (LMSD)
Common Name
4E,7Z,10Z-Tridecatrienyl acetate
Systematic Name
4E,7Z,10Z-Tridecatrienyl acetate
Synonyms
3D model of 4E,7Z,10Z-Tridecatrienyl acetate
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
References
String Representations
InChiKey (Click to copy)
WSXRBDKQLAZFRN-OZENSHFISA-N
InChi (Click to copy)
InChI=1S/C15H24O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-17-15(2)16/h4-5,7-8,10-11H,3,6,9,12-14H2,1-2H3/b5-4-,8-7-,11-10+
SMILES (Click to copy)
O(C(=O)C)CCC/C=C/C/C=C\C/C=C\CC
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
17
Rings
0
Aromatic Rings
0
Rotatable Bonds
10
Van der Waals Molecular Volume
275.08
Topological Polar Surface Area
26.30
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
2
logP
4.47
Molar Refractivity
73.30
Admin
Created at
-
Updated at
6th Jun 2022