Structure Database (LMSD)

Common Name
3,5-Dimethyldodecane
Systematic Name
3,5-Dimethyldodecane
Synonyms
LM ID
LMFA11000366
Formula
C14H30
Exact Mass
Calculate m/z
198.234751
Status
Curated
Show lipids differing only in stereochemistry/bond geometry

Classification

Category
Main Class
Sub Class
Fatty Acyls [FA]
Hydrocarbons [FA11]

References

Comments
Pherobase Semiochemicals

String Representations

InChiKey (Click to copy)
XZGJLSWBVWBSQT-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C14H30/c1-5-7-8-9-10-11-14(4)12-13(3)6-2/h13-14H,5-12H2,1-4H3
SMILES (Click to copy)
CCC(C)CC(C)CCCCCCC

Other Databases

PubChem CID
517894

Calculated Physicochemical Properties

Heavy Atoms 14
Rings 0
Aromatic Rings 0
Rotatable Bonds 9
Van der Waals Molecular Volume 250.76
Topological Polar Surface Area 0.00
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 0
logP 5.42
Molar Refractivity 66.61

Admin

Created at
-
Updated at
-