Structure Database (LMSD)
Common Name
Undecan-6-one
Systematic Name
Undecan-6-one
Synonyms
3D model of Undecan-6-one
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)
ZPQAKYPOZRXKFA-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C11H22O/c1-3-5-7-9-11(12)10-8-6-4-2/h3-10H2,1-2H3
SMILES (Click to copy)
CCCCCC(=O)CCCCC
References
Calculated Physicochemical Properties
Heavy Atoms
12
Rings
0
Aromatic Rings
0
Rotatable Bonds
8
Van der Waals Molecular Volume
205.01
Topological Polar Surface Area
17.07
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
1
logP
3.72
Molar Refractivity
53.29
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Created at
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Updated at
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