Structure Database (LMSD)
Common Name
2-undecenal
Systematic Name
2-undecenal
Synonyms
3D model of 2-undecenal
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)
PANBRUWVURLWGY-MDZDMXLPSA-N
InChi (Click to copy)
InChI=1S/C11H20O/c1-2-3-4-5-6-7-8-9-10-11-12/h9-11H,2-8H2,1H3/b10-9+
SMILES (Click to copy)
C(C)CCCCCC/C=C/C([H])=O
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
12
Rings
0
Aromatic Rings
0
Rotatable Bonds
8
Van der Waals Molecular Volume
202.37
Topological Polar Surface Area
17.07
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
1
logP
3.49
Molar Refractivity
53.20
Admin
Created at
-
Updated at
-