Structure Database (LMSD)
Common Name
2-Propenyl cyclohexanehexanoate
Systematic Name
prop-2-en-1-yl 6-cyclohexylhexanoate
Synonyms
3D model of 2-Propenyl cyclohexanehexanoate
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Classification
String Representations
InChiKey (Click to copy)
MMVNCZIEXUKMHF-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C15H26O2/c1-2-13-17-15(16)12-8-4-7-11-14-9-5-3-6-10-14/h2,14H,1,3-13H2
SMILES (Click to copy)
C1C(CCCCCC(OCC=C)=O)CCCC1
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
17
Rings
1
Aromatic Rings
0
Rotatable Bonds
9
Van der Waals Molecular Volume
268.00
Topological Polar Surface Area
26.30
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
2
logP
4.53
Molar Refractivity
71.31
Admin
Created at
-
Updated at
-