Structure Database (LMSD)
Common Name
C11354
Systematic Name
(2E,4Z)-2-hydroxyhexa-2,4-dienoic acid
Synonyms
- 2-Hydroxy-cis-hex-2,4-dienoate
- AKOS006374931
3D model of C11354
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
String Representations
InChiKey (Click to copy)
VPGPQVKJUYKKNN-AWYLAFAOSA-N
InChi (Click to copy)
InChI=1S/C6H8O3/c1-2-3-4-5(7)6(8)9/h2-4,7H,1H3,(H,8,9)/b3-2-,5-4+
SMILES (Click to copy)
O/C(/C(=O)O)=C/C=C\C
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
9
Rings
0
Aromatic Rings
0
Rotatable Bonds
2
Van der Waals Molecular Volume
130.81
Topological Polar Surface Area
57.53
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
3
logP
1.09
Molar Refractivity
33.16
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Created at
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Updated at
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