Structure Database (LMSD)

Common Name
9-Methylpentacosane
Systematic Name
9-Methylpentacosane
Synonyms
LM ID
LMFA11000558
Formula
C26H54
Exact Mass
Calculate m/z
366.42255
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)
NWCZRGQLDBQIFH-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C26H54/c1-4-6-8-10-12-13-14-15-16-17-18-19-21-23-25-26(3)24-22-20-11-9-7-5-2/h26H,4-25H2,1-3H3
SMILES (Click to copy)
CCCCCCCCC(C)CCCCCCCCCCCCCCCC

Other Databases

PubChem CID
526129

Calculated Physicochemical Properties

Heavy Atoms 26
Rings 0
Aromatic Rings 0
Rotatable Bonds 22
Van der Waals Molecular Volume 458.36
Topological Polar Surface Area 0.00
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 0
logP 10.24
Molar Refractivity 122.09

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Created at
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Updated at
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