LBF18000BC11: Difference between revisions

Revision as of 23:00, 19 February 2010

Upper classes: LB LBF

5-Methyl Octadecanoic Acid

Structural Information
	5-Methyl Octadecanoic Acid
	5-Methyl Octadecanoic Acid

Formula	C19H38O2
Exact Mass	298.28718046
Average Mass	298.50382
SMILES	`CCCCCCCCCCCCCC(C)CCCC(O)=O`
Physicochemical Information
	44.5-45°C Cason_J et al.
	174°C/0.1mmHg





	Diethyl ester of (3-methyl tetradecyl) malonate was heated with ethanolic KOH. After acidification the product was obtained by distillation under deminished pressure.

	Freeman_NK Cason_J et al.


Spectral Information
Mass Spectra
UV Spectra	209nm Cason_Jet al.
IR Spectra	7.76μ, 8.25μ(CS2) Freeman_NK
NMR Spectra
Other Spectra
Chromatograms

Reported Metabolites, References

Biospecies	ID	Compound Name	Reference
n.a.	LBF18000BC11	See above.	Cason_J et al. 1951
n.a.	LBF18000BC11	See above.	Cason_J et al. 1950
n.a.	LBF18000BC11	See above.	Freeman_NK 1952

@@ Line 11: / Line 11: @@
 |Boiling Point=174°C/0.1mmHg<!--7073-->
 |UV Spectra=209nm [[Reference:Cason_J:Sumrell_G:,J. Org. Chem.,1951,16,1177|{{RelationTable/GetFirstAuthor|Reference:Cason_J:Sumrell_G:,J. Org. Chem.,1951,16,1177}}]]
-|IR Spectra=7.76<FONT FACE="Symbol">m</FONT>, 8.25<FONT FACE="Symbol">m</FONT>(CS2) [[Reference:Freeman_NK:,J. Am. Chem. Soc.,1952,74,2523|{{RelationTable/GetFirstAuthor|Reference:Freeman_NK:,J. Am. Chem. Soc.,1952,74,2523}}]]
+|IR Spectra=7.76mu, 8.25mu(CS2) [[Reference:Freeman_NK:,J. Am. Chem. Soc.,1952,74,2523|{{RelationTable/GetFirstAuthor|Reference:Freeman_NK:,J. Am. Chem. Soc.,1952,74,2523}}]]
 |Source=
 |Chemical Synthesis=Diethyl ester of (3-methyl tetradecyl) malonate was heated with ethanolic KOH. After acidification the product was obtained by distillation under deminished pressure<!--7073-->.