Structure Database (LMSD)
Common Name
6-isopentyl-9-methyl-5-decenoic acid
Systematic Name
6-isopentyl-9-methyl-5-decenoic acid
Synonyms
3D model of 6-isopentyl-9-methyl-5-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)
KELKYPRDCHFVOX-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C16H30O2/c1-13(2)9-11-15(12-10-14(3)4)7-5-6-8-16(17)18/h7,13-14H,5-6,8-12H2,1-4H3,(H,17,18)
SMILES (Click to copy)
CC(C)CC/C(/CCC(C)C)=C/CCCC(=O)O
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
18
Rings
0
Aromatic Rings
0
Rotatable Bonds
10
Van der Waals Molecular Volume
297.66
Topological Polar Surface Area
37.30
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
logP
5.04
Molar Refractivity
77.71
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Created at
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Updated at
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