Structure Database (LMSD)
Common Name
octyl 2-methyl-propionyl
Systematic Name
octyl 2-methyl-propionyl
Synonyms
- WE(8:0/3:0(2Me))
No other lipid differing only in stereochemistry/bond geometry found
3D model of octyl 2-methyl-propionyl
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Main
Classification
Category
Main Class
Sub Class
String Representations
InChiKey (Click to copy)
PQCYCHFQWMNQRJ-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C12H24O2/c1-4-5-6-7-8-9-10-14-12(13)11(2)3/h11H,4-10H2,1-3H3
SMILES (Click to copy)
O=C(C(C)C)OCCCCCCCC
References
Comments
Pherobase Semiochemicals
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
14
Rings
0
Aromatic Rings
0
Rotatable Bonds
9
Van der Waals Molecular Volume
231.10
Topological Polar Surface Area
26.30
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
2
logP
3.83
Molar Refractivity
59.66
Admin
Created at
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Updated at
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