Structure Database (LMSD)

Common Name
3,7-Dimethylocta-2E,4E-diene
Systematic Name
3,7-Dimethylocta-2E,4E-diene
Synonyms
LM ID
LMFA11000046
Status
Active
Exact Mass
Calculate m/z
138.14085
Formula


Download as...
MDLMOL SDF CSV TSV
MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".

Main

Classification

Category
Main Class
Sub Class

String Representations

InChiKey (Click to copy)
NXFMFYVNTLULFW-SOYUKNQTSA-N
InChi (Click to copy)
InChI=1S/C10H18/c1-5-10(4)8-6-7-9(2)3/h5-6,8-9H,7H2,1-4H3/b8-6+,10-5+
SMILES (Click to copy)
C/C=C(\C)/C=C/CC(C)C

References

Comments
Pherobase Semiochemicals

Other Databases

CHEBI ID
PubChem CID

Calculated Physicochemical Properties

Heavy Atoms 10
Rings 0
Aromatic Rings 0
Rotatable Bonds 3
Van der Waals Molecular Volume 176.28
Topological Polar Surface Area 0.00
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 0
logP 3.55
Molar Refractivity 48.03

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Created at
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Updated at
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