Structure Database (LMSD)
Common Name
1,14-Pentadecadien-3-one
Systematic Name
1,14-Pentadecadien-3-one
Synonyms
3D model of 1,14-Pentadecadien-3-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)
USROZSBBFMADSY-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C15H28O/c1-3-5-6-7-8-9-10-11-12-13-14-15(16)4-2/h3H,1,4-14H2,2H3
SMILES (Click to copy)
CCC(=O)CCCCCCCCCCC=C
References
Calculated Physicochemical Properties
Heavy Atoms
16
Rings
0
Aromatic Rings
0
Rotatable Bonds
12
Van der Waals Molecular Volume
271.57
Topological Polar Surface Area
17.07
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
1
logP
5.05
Molar Refractivity
71.67
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Created at
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Updated at
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