Structure Database (LMSD)
Common Name
Acetic acid
Systematic Name
ethanoic acid
Synonyms
- Vinegar acid
- 10.Methanecarboxylic acid
- acetate
- C2:0
3D model of Acetic acid
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Main
Classification
Category
Main Class
Sub Class
String Representations
InChiKey (Click to copy)
QTBSBXVTEAMEQO-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C2H4O2/c1-2(3)4/h1H3,(H,3,4)
SMILES (Click to copy)
CC(=O)O
References
Other Databases
Wikipedia
KEGG ID
HMDB ID
CHEBI ID
LIPIDBANK ID
DFA0002
PubChem CID
PlantFA ID
SwissLipids ID
PDB ID
GuidePharm ID
Calculated Physicochemical Properties
Heavy Atoms
4
Rings
0
Aromatic Rings
0
Rotatable Bonds
0
Van der Waals Molecular Volume
58.10
Topological Polar Surface Area
37.30
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
logP
0.09
Molar Refractivity
13.31
Reactions
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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.
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Admin
Created at
-
Updated at
25th Apr 2022