Structure Database (LMSD)
Common Name
2,4,6-trimethyl-2,15-tetracosadienoic acid
Systematic Name
2,4,6-trimethyl-2,15-tetracosadienoic acid
Synonyms
3D model of 2,4,6-trimethyl-2,15-tetracosadienoic acid
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)
KPNSOKYZIINHDY-GVKIQVMWSA-N
InChi (Click to copy)
InChI=1S/C27H50O2/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24(2)22-25(3)23-26(4)27(28)29/h12-13,23-25H,5-11,14-22H2,1-4H3,(H,28,29)/b13-12+,26-23+
SMILES (Click to copy)
C(/C(/C)=C/C(C)CC(C)CCCCCCCC/C=C/CCCCCCCC)(=O)O
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
29
Rings
0
Aromatic Rings
0
Rotatable Bonds
20
Van der Waals Molecular Volume
485.32
Topological Polar Surface Area
37.30
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
logP
9.11
Molar Refractivity
128.41
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Created at
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Updated at
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