Structure Database (LMSD)

Common Name
3-Methylnonadecane
Systematic Name
3-Methylnonadecane
Synonyms
LM ID
LMFA11000400
Formula
C20H42
Exact Mass
Calculate m/z
282.32865
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)
NYRRMADCQLTNBX-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C20H42/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(3)5-2/h20H,4-19H2,1-3H3
SMILES (Click to copy)
CCC(C)CCCCCCCCCCCCCCCC

Other Databases

PubChem CID
94322

Calculated Physicochemical Properties

Heavy Atoms 20
Rings 0
Aromatic Rings 0
Rotatable Bonds 16
Van der Waals Molecular Volume 354.56
Topological Polar Surface Area 0.00
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 0
logP 7.90
Molar Refractivity 94.38

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Updated at
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