Structure Database (LMSD)
Common Name
6Z-Heptadecen-2-one
Systematic Name
6Z-Heptadecen-2-one
Synonyms
3D model of 6Z-Heptadecen-2-one
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Classification
String Representations
InChiKey (Click to copy)
WDQVOICTNHEZPR-SEYXRHQNSA-N
InChi (Click to copy)
InChI=1S/C17H32O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(2)18/h12-13H,3-11,14-16H2,1-2H3/b13-12-
SMILES (Click to copy)
CC(=O)CCC/C=C\CCCCCCCCCC
Other Databases
PubChem CID
Calculated Physicochemical Properties
Heavy Atoms
18
Rings
0
Aromatic Rings
0
Rotatable Bonds
13
Van der Waals Molecular Volume
306.17
Topological Polar Surface Area
17.07
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
1
logP
5.83
Molar Refractivity
80.90
Admin
Created at
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Updated at
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