Structure Database (LMSD)
Common Name
Acrylic acid
Systematic Name
2-propenoic acid
Synonyms
- C3:1n-1
3D model of Acrylic 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
Reactions
Filter by species:
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Reactions are shown if the E.C. number of the enzyme catalysing it is annotated in the UniProt database for a species belonging to the selected taxonomic class.
Click on an edge to display the reaction(s).
String Representations
InChiKey (Click to copy)
NIXOWILDQLNWCW-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C3H4O2/c1-2-3(4)5/h2H,1H2,(H,4,5)
SMILES (Click to copy)
C=CC(=O)O
Other Databases
Wikipedia
KEGG ID
HMDB ID
CHEBI ID
LIPIDBANK ID
DFA0040
PubChem CID
PlantFA ID
PDB ID
Calculated Physicochemical Properties
Heavy Atoms
5
Rings
0
Aromatic Rings
0
Rotatable Bonds
1
Van der Waals Molecular Volume
72.76
Topological Polar Surface Area
37.30
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
logP
0.26
Molar Refractivity
17.83
Admin
Created at
-
Updated at
25th Apr 2022