Acetate
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Basic information
- CAS
71-50-1- Standard SMILES
CC(=O)[O-]- InChIKey
QTBSBXVTEAMEQO-UHFFFAOYSA-M- Molecular formula
- C2H3O2-
- Average molar mass
- 59.04 g/mol
- Monoisotopic mass
- 59.01330433
Overview
Acetate is a monocarboxylic acid anion resulting from the removal of a proton from the carboxy group of acetic acid. It has a role as a Saccharomyces cerevisiae metabolite and a human metabolite. It is a conjugate base of an acetic acid.
Names & identifiers
- Preferred name
- Acetate
- IUPAC
- acetate
- English name
- acetate
- Molecular formula
- C2H3O2-
- Molecular weight
- 59.04
Names & synonyms
acetateAcetate Ion71-50-1Acetic acid, ion(1-)Acetate ionsAcetate anionAcetoxy ionAcetic acid anionethanoateAcetate ion (1-)569DQM74SCNatriumazetat
Show more names
ACETAcetic acid ionAcetic acid, ion(1-) (8CI,9CI)Ion Chromatography Anion Std acetateUSP Solution Acetate Buffer TS Conforms to USPIon Chromatography Anion Std acetate 1mg/mL (1000 ppm)(S)-1-(2-Amino-2-carboxyethyl)-3-(2-carboxy-5-phenylthiophene-3-yl-methyl)-5-methylpyrimidine-2,4-dione
Shotgunmonoacetate(C2 H3 O)2-Acetate Standard: CH3CO2- @ 1000 microg/mL in H2OUNII-569DQM74SCracemic acetateacetyl hydroxideAcetic cid glacial
Database identifiers
- CAS
71-50-1- PubChem CID
- 175
- DTXSID
DTXSID1037694- ChEBI
CHEBI:30089- UNII
- 569DQM74SC
- Nikkaji
- J209.470C
Properties
Computed structural propertiesFilling in
- XLogP
- 0.4
- Topological polar surface area
- 40.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 4
- Formal charge
- -1
- Complexity
- 25.5
Physicochemical properties
- storage temp.
- Store at RT
- FDA UNII
- 569 DQM74SC · 569DQM74SC
- EPA Substance Registry System
- Acetate ion (71-50-1)
Chemistry & industry
Applications
UsesACET is a potent and selective GluR5-containing kainate receptor antagonist.
Upstream & downstream products
Upstream raw materials
Downstream products
Additional notes
DefinitionChEBI: A monocarboxylic acid anion resulting from the removal of a proton from the carboxy group of acetic acid.
Related reactions
8,391 records
Compound notes
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