Structure Database (LMSD)

Common Name
4,16-Dimethyltetratriacontane
Systematic Name
4,16-Dimethyltetratriacontane
Synonyms
LM ID
LMFA11000414
Formula
C36H74
Exact Mass
Calculate m/z
506.57905
Status
Active
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)
BDCGIVZYVQMCFJ-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C36H74/c1-5-7-8-9-10-11-12-13-14-15-16-17-19-23-26-29-33-36(4)34-30-27-24-21-18-20-22-25-28-32-35(3)31-6-2/h35-36H,5-34H2,1-4H3
SMILES (Click to copy)
CCCC(C)CCCCCCCCCCCC(C)CCCCCCCCCCCCCCCCCC

Other Databases

PubChem CID
6430426

Calculated Physicochemical Properties

Heavy Atoms 36
Rings 0
Aromatic Rings 0
Rotatable Bonds 31
Van der Waals Molecular Volume 631.36
Topological Polar Surface Area 0.00
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 0
logP 14.00
Molar Refractivity 168.19

Admin

Created at
-
Updated at
-