Structure Database (LMSD)

Common Name
cis-6,7-epoxy-9Z-heptadecene
Systematic Name
cis-6,7-epoxy-9Z-heptadecene
Synonyms
LM ID
LMFA12000271
Status
Active
Exact Mass
Calculate m/z
252.245315
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

String Representations

InChiKey (Click to copy)
DZBUIPPAEPQLKL-QBFSEMIESA-N
InChi (Click to copy)
InChI=1S/C17H32O/c1-3-5-7-8-9-10-11-13-15-17-16(18-17)14-12-6-4-2/h11,13,16-17H,3-10,12,14-15H2,1-2H3/b13-11-
SMILES (Click to copy)
CCCCCC1OC1C/C=C\CCCCCCC

References

Comments
Pherobase Semiochemicals

Other Databases

PubChem CID

Calculated Physicochemical Properties

Heavy Atoms 18
Rings 1
Aromatic Rings 0
Rotatable Bonds 12
Van der Waals Molecular Volume 296.45
Topological Polar Surface Area 12.53
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 1
logP 6.21
Molar Refractivity 80.96

Admin

Created at
-
Updated at
-