Structure Database (LMSD)
Common Name
SFE 9:1(6E)/2:0
Systematic Name
6E-Nonenyl acetate
Synonyms
- SFE(9:1(6E)/2:0)
3D model of SFE 9:1(6E)/2:0
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Classification
Category
Main Class
Sub Class
References
Comments
Pherobase
Taxonomy Information
Curated from
NCBI taxonomy class
Reference
synthetic construct
(#32630)
trans-6-Nonen-l-ol Acetate: An Ovipositional Attractant and Stimulant of the Melon Fly,
J Econ Entomol, 1973
J Econ Entomol, 1973
String Representations
InChiKey (Click to copy)
DFRXMRZQBMFKMI-SNAWJCMRSA-N
InChi (Click to copy)
InChI=1S/C11H20O2/c1-3-4-5-6-7-8-9-10-13-11(2)12/h4-5H,3,6-10H2,1-2H3/b5-4+
SMILES (Click to copy)
O(C(=O)C)CCCCC/C=C/CC
Other Databases
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
3.36
Molar Refractivity
55.02
Admin
Created at
-
Updated at
31st Jul 2023