Structure Database (LMSD)
Common Name
2E,6Z-farnesal
Systematic Name
3,7,11-trimethyldodeca-2Z,6E,10-trienal
Synonyms
3D model of 2E,6Z-farnesal
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
Level 4 Class
String Representations
InChiKey (Click to copy)
YHRUHBBTQZKMEX-PVMFERMNSA-N
InChi (Click to copy)
InChI=1S/C15H24O/c1-13(2)7-5-8-14(3)9-6-10-15(4)11-12-16/h7,9,11-12H,5-6,8,10H2,1-4H3/b14-9+,15-11-
SMILES (Click to copy)
C/C(=C/C=O)/CC/C=C(\C)/CC/C=C(\C)/C
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
16
Rings
0
Aromatic Rings
0
Rotatable Bonds
7
Van der Waals Molecular Volume
266.29
Topological Polar Surface Area
17.07
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
1
logP
4.60
Molar Refractivity
71.48
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Created at
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Updated at
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