Structure Database (LMSD)
Systematic Name
2-Ethyl-1,6-dioxaspiro[4.4]nonane
Synonyms
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)
DCWKALWZHORJAO-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C9H16O2/c1-2-8-4-6-9(11-8)5-3-7-10-9/h8H,2-7H2,1H3
SMILES (Click to copy)
O1C2(CCCO2)CCC1CC
References
Calculated Physicochemical Properties
Heavy Atoms
11
Rings
2
Aromatic Rings
0
Rotatable Bonds
1
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
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Created at
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Updated at
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