Structure Database (LMSD)
Common Name
7-hydroxy-5-heptynoic acid
Systematic Name
7-hydroxy-5-heptynoic acid
Synonyms
- 5-Heptynoic acid, 7-hydroxy-
- 7-Hydroxy-5-heptynoic acid
3D model of 7-hydroxy-5-heptynoic 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)
YVZAOBOYHMHYKV-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C7H10O3/c8-6-4-2-1-3-5-7(9)10/h8H,1,3,5-6H2,(H,9,10)
SMILES (Click to copy)
C(CCCC#CCO)(=O)O
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
10
Rings
0
Aromatic Rings
0
Rotatable Bonds
3
Van der Waals Molecular Volume
148.11
Topological Polar Surface Area
57.53
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
3
logP
0.52
Molar Refractivity
36.84
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Created at
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Updated at
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