Structure Database (LMSD)

Common Name
(Z)-3-Decenyl (E)-3-hexenoate
Systematic Name
(Z)-3-Decenyl (E)-3-hexenoate
Synonyms
  • WE(10:1(3Z)/6:1(3E))
LM ID
LMFA07010531
Formula
Exact Mass
Calculate m/z
252.20893
Sum Composition
Status
Active

Classification

References

Comments
Pherobase Semiochemicals

String Representations

InChiKey (Click to copy)
OCQVOEZCKHLMRQ-FKPMBGQDSA-N
InChi (Click to copy)
InChI=1S/C16H28O2/c1-3-5-7-8-9-10-11-13-15-18-16(17)14-12-6-4-2/h6,10-12H,3-5,7-9,13-15H2,1-2H3/b11-10-,12-6+
SMILES (Click to copy)
O=C(C/C=C/CC)OCC/C=C\CCCCCC

Other Databases

CHEBI ID
PubChem CID

Calculated Physicochemical Properties

Heavy Atoms 18
Rings 0
Aromatic Rings 0
Rotatable Bonds 12
Van der Waals Molecular Volume 295.02
Topological Polar Surface Area 26.30
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 2
logP 5.09
Molar Refractivity 78.01

Admin

Created at
-
Updated at
-