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
Biological Context
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
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Created at
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Updated at
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