Structure database (LMSD)

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LM IDLMFA11000026
Common Name5S,9S-Dimethylheptadecane
Systematic Name5S,9S-Dimethylheptadecane
Synonyms-
Exact Mass
268.3130 (neutral)    Calculate m/z:
FormulaC19H40
CategoryFatty Acyls [FA]
Main ClassHydrocarbons [FA11]
Sub Class-
PubChem CID10563865
InChIKeyNAZZVMQIBMVGND-OALUTQOASA-N  Show lipids differing only in stereochemistry/bond geometry
InChIInChI=1S/C19H40/c1-5-7-9-10-11-12-15-19(4)17-13-16-18(3)14-8-6-2/h18-19H,5-17H2,
1-4H3/t18-,19-/m0/s1
SMILESCCCC[C@H](C)CCC[C@@H](C)CCCCCCCC
StatusActive
CommentsPherobase Semiochemicals
Calculated physicochemical properties (?):
 Heavy Atoms19Rings0Aromatic Rings0Rotatable Bonds14
 van der Waals
Molecular Volume
337.26Topological Polar
Surface Area
0.00Hydrogen
Bond Donors
0Hydrogen
Bond Acceptors
0
 logP7.37Molar
Refractivity
89.70