Structure Database (LMSD)

O O
Common Name
Methyl 4Z-decenoate
Systematic Name
Methyl 4Z-decenoate
Synonyms
  • WE(1:0/10:1(4Z))
LM ID
LMFA07010477
Formula
C11H20O2
Exact Mass
Calculate m/z
184.14633
Sum Composition
SFE 11:1
Status
Active
Show lipids differing only in stereochemistry/bond geometry

Main

Classification

Category
Main Class
Sub Class
Fatty Acyls [FA]
Fatty esters [FA07]
Short fatty esters [FA0710]
Fatty Acids and Conjugates [FA01]
Unsaturated fatty acids [FA0103]

String Representations

InChiKey (Click to copy)
CRHITZQXHNFRAZ-FPLPWBNLSA-N
InChi (Click to copy)
InChI=1S/C11H20O2/c1-3-4-5-6-7-8-9-10-11(12)13-2/h7-8H,3-6,9-10H2,1-2H3/b8-7-
SMILES (Click to copy)
O=C(CC/C=C\CCCCC)OC

References

Comments
Pherobase Semiochemicals

Other Databases

PubChem CID
5352371

Calculated Physicochemical Properties

Heavy Atoms 13
Rings 0
Aromatic Rings 0
Rotatable Bonds 8
Van der Waals Molecular Volume 211.16
Topological Polar Surface Area 26.30
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 2
logP 3.08
Molar Refractivity 54.53

Admin

Created at
-
Updated at
6th Jun 2022