Structure Database (LMSD)
Common Name
6,7-methylene-pentadecanoic acid
Systematic Name
6,7-methylene-pentadecanoic acid
Synonyms
- 2-Octylcyclopropanepentanoic acid
3D model of 6,7-methylene-pentadecanoic acid
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Main
Classification
Category
Main Class
Sub Class
String Representations
InChiKey (Click to copy)
YPMKDOYCNARBES-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C16H30O2/c1-2-3-4-5-6-7-10-14-13-15(14)11-8-9-12-16(17)18/h14-15H,2-13H2,1H3,(H,17,18)
SMILES (Click to copy)
C1(CCCCC(O)=O)CC1CCCCCCCC
References
Calculated Physicochemical Properties
Heavy Atoms
18
Rings
1
Aromatic Rings
0
Rotatable Bonds
12
Van der Waals Molecular Volume
287.94
Topological Polar Surface Area
37.3
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
logP
5.02
Molar Refractivity
75.69
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Created at
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Updated at
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