Structure Database (LMSD)
Common Name
5-oxo-7E-decenoic acid
Systematic Name
5-oxo-7E-decenoic acid
Synonyms
3D model of 5-oxo-7E-decenoic acid
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Classification
Category
Main Class
Sub Class
String Representations
InChiKey (Click to copy)
XDXKSZVTGHYJAD-ONEGZZNKSA-N
InChi (Click to copy)
InChI=1S/C10H16O3/c1-2-3-4-6-9(11)7-5-8-10(12)13/h3-4H,2,5-8H2,1H3,(H,12,13)/b4-3+
SMILES (Click to copy)
C(CCCC(=O)C/C=C/CC)(=O)O
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
13
Rings
0
Aromatic Rings
0
Rotatable Bonds
7
Van der Waals Molecular Volume
200.01
Topological Polar Surface Area
54.37
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
3
logP
2.17
Molar Refractivity
50.54
Admin
Created at
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Updated at
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