Arsenate ion (ECMDB23941) (M2MDB006050)

IdentificationTaxonomyPhysical PropertiesBiological PropertiesSpectraConcentrationsLinksReferencesXML
Proteins (2)
Record Information
Version2.0
Creation Date2015-07-03 14:13:56 -0600
Update Date2015-08-05 16:22:05 -0600
Secondary Accession Numbers
  • ECMDB23941
Identification
Name:Arsenate ion
DescriptionThe arsenate ion is AsO43−. An arsenate (compound) is any compound that contains this ion. Arsenates are salts or esters of arsenic acid.
Structure
Thumb
MOLSDFPDBSMILESInChI
Synonyms:
  • Arsenate
  • Arsenic acid
  • Arsenic acid ion
Chemical Formula:AsO4
Weight:Average: 138.9192
Monoisotopic: 138.901254905
InChI Key:DJHGAFSJWGLOIV-UHFFFAOYSA-K
InChI:InChI=1S/AsH3O4/c2-1(3,4)5/h(H3,2,3,4,5)/p-3
CAS number:15584-04-0
IUPAC Name:arsorate
Traditional IUPAC Name:arsenate
SMILES:[O-][As]([O-])([O-])=O
Chemical Taxonomy
Description belongs to the class of inorganic compounds known as miscellaneous arsenates. These are inorganic compounds in which the largest metallic oxoanion is arsenate, to which either no atom or a non metal atom is bonded.
KingdomInorganic compounds
Super ClassMixed metal/non-metal compounds
ClassMiscellaneous mixed metal/non-metals
Sub ClassMiscellaneous metallic oxoanionic compounds
Direct ParentMiscellaneous arsenates
Alternative Parents
Substituents
  • Arsenate
  • Inorganic oxide
  • Inorganic salt
  • Inorganic metalloid salt
  • Inorganic arsenic compound
Molecular FrameworkNot Available
External Descriptors
Physical Properties
State:Not Available
Charge:-2
Melting point:Not Available
Experimental Properties:
PropertyValueSource
Predicted Properties
PropertyValueSource
logP-1.2ChemAxon
pKa (Strongest Acidic)3.15ChemAxon
Physiological Charge-2ChemAxon
Hydrogen Acceptor Count4ChemAxon
Hydrogen Donor Count0ChemAxon
Polar Surface Area86.25 ŲChemAxon
Rotatable Bond Count0ChemAxon
Refractivity5.77 m³·mol⁻¹ChemAxon
Polarizability6.3 ųChemAxon
Number of Rings0ChemAxon
Bioavailability1ChemAxon
Rule of FiveYesChemAxon
Ghose FilterYesChemAxon
Veber's RuleYesChemAxon
MDDR-like RuleYesChemAxon
Biological Properties
Cellular Locations:Cytoplasm
Reactions:
Arsenate ion + Glutaredoxin <> Arsenite + Glutaredoxin disulfide + Water
Arsenate ion + Glutaredoxin <> Arsenite + Glutaredoxin disulfide + Water
SMPDB Pathways:Not Available
KEGG Pathways:Not Available
EcoCyc Pathways:Not Available
Concentrations
Not Available
Spectra
Spectra:
Spectrum TypeDescriptionSplash Key
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 10V, Positivesplash10-000i-0900000000-2300d8515ccffe0c72a9View in MoNA
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 20V, Positivesplash10-000i-0900000000-95f73cf0031fd9db70a4View in MoNA
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 40V, Positivesplash10-000i-1900000000-63b86308e175834b3737View in MoNA
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 10V, Negativesplash10-000i-0900000000-0f9bfd20563272df8ed3View in MoNA
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 20V, Negativesplash10-00kr-7900000000-3732e044cbf7f4af867dView in MoNA
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 40V, Negativesplash10-000i-0900000000-e0eaa97a5c9721cbf258View in MoNA
References
References:Not Available
Synthesis Reference:Not Available
Material Safety Data Sheet (MSDS)Not Available
External Links:
ResourceLink
CHEBI ID29125
HMDB IDNot Available
Pubchem Compound ID27401
Kegg IDC11215
ChemSpider IDNot Available
Wikipedia IDNot Available
BioCyc IDNot Available