Structure database (LMSD)

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LM IDLMFA07010488
Common NameMethyl 2,6-dimethyl-tetradecanoate
Systematic NameMethyl 2,6-dimethyl-tetradecanoate
SynonymsWE(1:0/14:0(2Me,6Me))
Exact Mass
270.2559 (neutral)    Calculate m/z:
FormulaC17H34O2
CategoryFatty Acyls [FA]
Main ClassFatty esters [FA07]
Sub ClassWax monoesters [FA0701]
Alternative ClassesBranched fatty acids[FA0102]
AbbrevWE 17:0
PubChem CID56935976
InChIKeyGEHLQHHIWRFUCM-UHFFFAOYSA-N  Show lipids differing only in stereochemistry/bond geometry
InChI
InChI=1S/C17H34O2/c1-5-6-7-8-9-10-12-15(2)13-11-14-16(3)17(18)19-4/h15-16H,5-14H2,1-4H3
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SMILES
O=C(C(C)CCCC(C)CCCCCCCC)OC
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StatusActive
CommentsPherobase Semiochemicals
Calculated physicochemical properties (?):
 Heavy Atoms19Rings0Aromatic Rings0Rotatable Bonds13
 van der Waals
Molecular Volume
317.60Topological Polar
Surface Area
26.30Hydrogen
Bond Donors
0Hydrogen
Bond Acceptors
2
 logP5.35Molar
Refractivity
82.19