Structure Database (LMSD)
Systematic Name
2-Methyl-1,6-dioxaspiro[4.5]decane
Synonyms
No other lipid differing only in stereochemistry/bond geometry found
3D model of
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Main
Classification
String Representations
InChiKey (Click to copy)
JQEFEBJVAHPKHX-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C9H16O2/c1-8-4-6-9(11-8)5-2-3-7-10-9/h8H,2-7H2,1H3
SMILES (Click to copy)
O1C2(CCCCO2)CCC1C
References
Calculated Physicochemical Properties
Heavy Atoms
11
Rings
2
Aromatic Rings
0
Rotatable Bonds
0
Van der Waals Molecular Volume
157.12
Topological Polar Surface Area
22.60
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
2
logP
2.94
Molar Refractivity
43.83
Admin
Created at
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Updated at
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