Structure database (LMSD)

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LM IDLMFA11000572
Common NameHeneicosane
Systematic NameHeneicosane
Synonyms-
Exact Mass
296.3443 (neutral)    Calculate m/z:
FormulaC21H44
CategoryFatty Acyls [FA]
Main ClassHydrocarbons [FA11]
Sub Class-
PubChem CID12403
HMDB IDHMDB0061782
InChIKeyFNAZRRHPUDJQCJ-UHFFFAOYSA-N  Show lipids differing only in stereochemistry/bond geometry
InChIInChI=1S/C21H44/c1-3-5-7-9-11-13-15-17-19-21-20-18-16-14-12-10-8-6-4-2/h3-21H2,1
-2H3
SMILESCCCCCCCCCCCCCCCCCCCCC
MS SpectraView MoNA MS spectra     
StatusActive
CommentsPherobase Semiochemicals
Calculated physicochemical properties (?):
 Heavy Atoms21Rings0Aromatic Rings0Rotatable Bonds18
 van der Waals
Molecular Volume
371.86Topological Polar
Surface Area
0.00Hydrogen
Bond Donors
0Hydrogen
Bond Acceptors
0
 logP8.44Molar
Refractivity
99.07