Structure Database (LMSD)
Common Name
pentadeca-1Z,7Z,13Z-trien-9,11-diyne
Systematic Name
pentadeca-1Z,7Z,13Z-trien-9,11-diyne
Synonyms
3D model of pentadeca-1Z,7Z,13Z-trien-9,11-diyne
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Classification
References
String Representations
InChiKey (Click to copy)
XOARYMGRKLMBDE-VPHYMXCRSA-N
InChi (Click to copy)
InChI=1S/C15H18/c1-3-5-7-9-11-13-15-14-12-10-8-6-4-2/h3-4,6,13,15H,1,5,7,9,11H2,2H3/b6-4+,15-13-
SMILES (Click to copy)
C(=C/C#CC#C/C=C/C)/CCCCC=C
Other Databases
PubChem CID
Calculated Physicochemical Properties
Heavy Atoms
15
Rings
0
Aromatic Rings
0
Rotatable Bonds
5
Van der Waals Molecular Volume
249.58
Topological Polar Surface Area
0.00
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
0
logP
3.87
Molar Refractivity
68.17
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Created at
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Updated at
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