Structure Database (LMSD)

Common Name
11-Methyldocosane
Systematic Name
11-Methyldocosane
Synonyms
LM ID
LMFA11000209
Formula
C23H48
Exact Mass
Calculate m/z
324.3756
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)
UIVJOAIQJQOXTA-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C23H48/c1-4-6-8-10-12-14-16-18-20-22-23(3)21-19-17-15-13-11-9-7-5-2/h23H,4-22H2,1-3H3
SMILES (Click to copy)
CCCCCCCCCCC(C)CCCCCCCCCCC

Other Databases

PubChem CID
6428612

Calculated Physicochemical Properties

Heavy Atoms 23
Rings 0
Aromatic Rings 0
Rotatable Bonds 19
Van der Waals Molecular Volume 406.46
Topological Polar Surface Area 0.00
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 0
logP 9.07
Molar Refractivity 108.24

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Created at
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Updated at
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