Structure Database (LMSD)
Common Name
undecanal
Systematic Name
undecanal
Synonyms
3D model of undecanal
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)
KMPQYAYAQWNLME-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C11H22O/c1-2-3-4-5-6-7-8-9-10-11-12/h11H,2-10H2,1H3
SMILES (Click to copy)
C(C)CCCCCCCCC([H])=O
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
12
Rings
0
Aromatic Rings
0
Rotatable Bonds
9
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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