Structure Database (LMSD)
Common Name
Cyclopentanetridecanoic acid
Systematic Name
13-Cyclopentyltridecanoic acid
Synonyms
3D model of Cyclopentanetridecanoic 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)
GPWJVXHWELIFNF-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C18H34O2/c19-18(20)16-10-8-6-4-2-1-3-5-7-9-13-17-14-11-12-15-17/h17H,1-16H2,(H,19,20)
SMILES (Click to copy)
C(CCCCCCCCCCCCC1CCCC1)(=O)O
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
20
Rings
1
Aromatic Rings
0
Rotatable Bonds
13
Van der Waals Molecular Volume
322.54
Topological Polar Surface Area
37.3
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
logP
5.94
Molar Refractivity
85
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Created at
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Updated at
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