Structure Database (LMSD)

Common Name
12,16-Dimethyltriacontane
Systematic Name
12,16-Dimethyltriacontane
Synonyms
LM ID
LMFA11000225
Formula
C32H66
Exact Mass
Calculate m/z
450.51645
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)
DUGSPWQKDGAHKB-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C32H66/c1-5-7-9-11-13-15-16-17-19-21-23-25-28-32(4)30-26-29-31(3)27-24-22-20-18-14-12-10-8-6-2/h31-32H,5-30H2,1-4H3
SMILES (Click to copy)
CCCCCCCCCCCC(C)CCCC(C)CCCCCCCCCCCCCC

Other Databases

PubChem CID
14376675

Calculated Physicochemical Properties

Heavy Atoms 32
Rings 0
Aromatic Rings 0
Rotatable Bonds 27
Van der Waals Molecular Volume 562.16
Topological Polar Surface Area 0.00
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 0
logP 12.44
Molar Refractivity 149.72

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Created at
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Updated at
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