Structure Database (LMSD)
Common Name
7,8-methylenehexanoic acid
Systematic Name
7,8-methylenehexanoic acid
Synonyms
- 6-[2-octylcyclopropyl]hexanoic acid
- Cyclopropanehexanoic acid, 2-octyl-
- 7,8-Methylenehexadecanoic acid
3D model of 7,8-methylenehexanoic 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)
FMVHABNRCKPNEA-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C17H32O2/c1-2-3-4-5-6-8-11-15-14-16(15)12-9-7-10-13-17(18)19/h15-16H,2-14H2,1H3,(H,18,19)
SMILES (Click to copy)
C(O)(=O)CCCCCC1CC1CCCCCCCC
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
19
Rings
1
Aromatic Rings
0
Rotatable Bonds
13
Van der Waals Molecular Volume
305.24
Topological Polar Surface Area
37.3
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
logP
5.41
Molar Refractivity
80.31
Admin
Created at
-
Updated at
-