Structure database (LMSD)

  MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".
LM IDLMFA11000036
Common Name3E,7-Dimethyl-1,3,6-octatriene
Systematic Name3E,7-Dimethyl-1,3,6-octatriene
Synonyms-
Exact Mass
138.1409 (neutral)    Calculate m/z:
FormulaC10H18
CategoryFatty Acyls [FA]
Main ClassHydrocarbons [FA11]
Sub Class-
PubChem CID22236735
InChIKeyLQJJRPLOVQYMPJ-CSKARUKUSA-N  Show lipids differing only in stereochemistry/bond geometry
InChIInChI=1S/C10H18/c1-5-10(4)8-6-7-9(2)3/h7-8H,5-6H2,1-4H3/b10-8+
SMILESCC/C(/C)=C/C/C=C(\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
 logP3.70Molar
Refractivity
48.10