Structure Database (LMSD)
Common Name
2,6-dimethyl-undecanoic acid
Systematic Name
2,6-dimethyl-undecanoic acid
Synonyms
3D model of 2,6-dimethyl-undecanoic 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)
IWXDJEKSYPEGNS-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C13H26O2/c1-4-5-6-8-11(2)9-7-10-12(3)13(14)15/h11-12H,4-10H2,1-3H3,(H,14,15)
SMILES (Click to copy)
C(C)CCCC(C)CCCC(C)C(=O)O
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
15
Rings
0
Aromatic Rings
0
Rotatable Bonds
9
Van der Waals Molecular Volume
248.40
Topological Polar Surface Area
37.30
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
logP
4.09
Molar Refractivity
63.96
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Created at
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Updated at
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