Structure Database (LMSD)
Common Name
6-hydroxy-2-hexynoic acid
Systematic Name
6-hydroxy-2-hexynoic acid
Synonyms
- 2-Hexynoic acid, 6-hydroxy-
3D model of 6-hydroxy-2-hexynoic acid
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)
FMIGBDLVHMCZSR-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C6H8O3/c7-5-3-1-2-4-6(8)9/h7H,1,3,5H2,(H,8,9)
SMILES (Click to copy)
C(C#CCCCO)(=O)O
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
0.13
Molar Refractivity
32.22
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Created at
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Updated at
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