Structure database (LMSD)

  MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".
LM IDLMFA11000046
Common Name3,7-Dimethylocta-2E,4E-diene
Systematic Name3,7-Dimethylocta-2E,4E-diene
Synonyms-
Exact Mass
138.1409 (neutral)    Calculate m/z:
FormulaC10H18
CategoryFatty Acyls [FA]
Main ClassHydrocarbons [FA11]
Sub Class-
PubChem CID5463316
InChIKeyNXFMFYVNTLULFW-SOYUKNQTSA-N  Show lipids differing only in stereochemistry/bond geometry
InChIInChI=1S/C10H18/c1-5-10(4)8-6-7-9(2)3/h5-6,8-9H,7H2,1-4H3/b8-6+,10-5+
SMILESC/C=C(\C)/C=C/CC(C)C
StatusActive
CommentsPherobase Semiochemicals
Calculated physicochemical properties (?):
 Heavy Atoms10Rings0Aromatic Rings0Rotatable Bonds3
 van der Waals
Molecular Volume
176.28Topological Polar
Surface Area
0.00Hydrogen
Bond Donors
0Hydrogen
Bond Acceptors
0
 logP3.55Molar
Refractivity
48.03