Structure Database (LMSD)
Common Name
2,12-dimethyltetradecanoic acid
Systematic Name
2,12-dimethyltetradecanoic acid
Synonyms
3D model of 2,12-dimethyltetradecanoic 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
References
String Representations
InChiKey (Click to copy)
SXILUVNCFRWCCF-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C16H32O2/c1-4-14(2)12-10-8-6-5-7-9-11-13-15(3)16(17)18/h14-15H,4-13H2,1-3H3,(H,17,18)
SMILES (Click to copy)
C(=O)(O)C(C)CCCCCCCCCC(C)CC
Other Databases
PubChem CID
Calculated Physicochemical Properties
Heavy Atoms
18
Rings
0
Aromatic Rings
0
Rotatable Bonds
12
Van der Waals Molecular Volume
300.30
Topological Polar Surface Area
37.30
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
logP
5.26
Molar Refractivity
77.81
Admin
Created at
8th May 2020
Updated at
29th Mar 2024