Record Information
Version1.0
Creation Date2016-05-19 02:55:25 UTC
Update Date2016-11-09 01:13:53 UTC
Accession NumberCHEM008939
Identification
Common NameCobalt(2+) sulfate heptahydrate
ClassSmall Molecule
DescriptionA hydrate that is the heptahydrate form of cobalt(2+) sulfate.
Contaminant Sources
  • HPV EPA Chemicals
  • IARC Carcinogens Group 2B
  • OECD HPV Chemicals
  • ToxCast & Tox21 Chemicals
Contaminant TypeNot Available
Chemical Structure
Thumb
Synonyms
ValueSource
Cobalt monosulfate heptahydrateChEBI
Cobalt sulfate heptahydrateChEBI
Cobalt(II) sulfate heptahydrateChEBI
Cobaltous sulfate heptahydrateChEBI
Cobalt(II) sulfateKegg
Cobalt monosulfuric acid heptahydric acidGenerator
Cobalt monosulphate heptahydrateGenerator
Cobalt monosulphuric acid heptahydric acidGenerator
Cobalt sulfuric acid heptahydric acidGenerator
Cobalt sulphate heptahydrateGenerator
Cobalt sulphuric acid heptahydric acidGenerator
Cobalt(II) sulfuric acid heptahydric acidGenerator
Cobalt(II) sulphate heptahydrateGenerator
Cobalt(II) sulphuric acid heptahydric acidGenerator
Cobaltous sulfuric acid heptahydric acidGenerator
Cobaltous sulphate heptahydrateGenerator
Cobaltous sulphuric acid heptahydric acidGenerator
Cobalt(II) sulfuric acidGenerator
Cobalt(II) sulphateGenerator
Cobalt(II) sulphuric acidGenerator
Cobalt(2+) sulfuric acid heptahydric acidGenerator
Cobalt(2+) sulphate heptahydrateGenerator
Cobalt(2+) sulphuric acid heptahydric acidGenerator
Chemical FormulaCoH14O11S
Average Molecular Mass281.103 g/mol
Monoisotopic Mass280.959 g/mol
CAS Registry Number10026-24-1
IUPAC Nameλ²-cobalt(2+) ion heptahydrate sulfate
Traditional Nameλ²-cobalt(2+) ion heptahydrate sulfate
SMILESO.O.O.O.O.O.O.[Co++].[O-]S([O-])(=O)=O
InChI IdentifierInChI=1S/Co.H2O4S.7H2O/c;1-5(2,3)4;;;;;;;/h;(H2,1,2,3,4);7*1H2/q+2;;;;;;;;/p-2
InChI KeyMEYVLGVRTYSQHI-UHFFFAOYSA-L
Chemical Taxonomy
Description belongs to the class of inorganic compounds known as transition metal sulfates. These are inorganic compounds in which the largest oxoanion is sulfate, and in which the heaviest atom not in an oxoanion is a transition metal.
KingdomInorganic compounds
Super ClassMixed metal/non-metal compounds
ClassTransition metal oxoanionic compounds
Sub ClassTransition metal sulfates
Direct ParentTransition metal sulfates
Alternative Parents
Substituents
  • Transition metal sulfate
  • Inorganic cobalt salt
  • Inorganic oxide
  • Inorganic salt
Molecular FrameworkNot Available
External DescriptorsNot Available
Biological Properties
StatusDetected and Not Quantified
OriginNot Available
Cellular LocationsNot Available
Biofluid LocationsNot Available
Tissue LocationsNot Available
PathwaysNot Available
ApplicationsNot Available
Biological RolesNot Available
Chemical RolesNot Available
Physical Properties
StateNot Available
AppearanceNot Available
Experimental Properties
PropertyValue
Melting PointNot Available
Boiling PointNot Available
SolubilityNot Available
Predicted Properties
PropertyValueSource
logP-0.84ChemAxon
pKa (Strongest Acidic)-3ChemAxon
Physiological Charge-2ChemAxon
Hydrogen Acceptor Count4ChemAxon
Hydrogen Donor Count0ChemAxon
Polar Surface Area80.26 ŲChemAxon
Rotatable Bond Count0ChemAxon
Refractivity11.53 m³·mol⁻¹ChemAxon
Polarizability5.81 ųChemAxon
Number of Rings0ChemAxon
Bioavailability1ChemAxon
Rule of FiveYesChemAxon
Ghose FilterNoChemAxon
Veber's RuleNoChemAxon
MDDR-like RuleNoChemAxon
Spectra
Spectra
Spectrum TypeDescriptionSplash KeyView
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 10V, Positivesplash10-001i-0090000000-360bb7eaa7888395e289Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 20V, Positivesplash10-001i-0090000000-360bb7eaa7888395e289Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 40V, Positivesplash10-001i-0090000000-360bb7eaa7888395e289Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 10V, Negativesplash10-004i-0090000000-068b4cfa54c4560015e9Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 20V, Negativesplash10-004i-0090000000-068b4cfa54c4560015e9Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 40V, Negativesplash10-004i-0090000000-068b4cfa54c4560015e9Spectrum
Toxicity Profile
Route of ExposureNot Available
Mechanism of ToxicityNot Available
MetabolismNot Available
Toxicity ValuesNot Available
Lethal DoseNot Available
Carcinogenicity (IARC Classification)Not Available
Uses/SourcesNot Available
Minimum Risk LevelNot Available
Health EffectsNot Available
SymptomsNot Available
TreatmentNot Available
Concentrations
Not Available
DrugBank IDNot Available
HMDB IDNot Available
FooDB IDNot Available
Phenol Explorer IDNot Available
KNApSAcK IDNot Available
BiGG IDNot Available
BioCyc IDNot Available
METLIN IDNot Available
PDB IDNot Available
Wikipedia LinkCobalt(II)_sulfate
Chemspider IDNot Available
ChEBI ID91244
PubChem Compound ID61444
Kegg Compound IDC19215
YMDB IDNot Available
ECMDB IDNot Available
References
Synthesis ReferenceNot Available
MSDSNot Available
General References
1. https://www.ncbi.nlm.nih.gov/pubmed/?term=10504146
2. https://www.ncbi.nlm.nih.gov/pubmed/?term=12187935
3. https://www.ncbi.nlm.nih.gov/pubmed/?term=12209163
4. https://www.ncbi.nlm.nih.gov/pubmed/?term=12579202
5. https://www.ncbi.nlm.nih.gov/pubmed/?term=12948248
6. https://www.ncbi.nlm.nih.gov/pubmed/?term=2227161
7. https://www.ncbi.nlm.nih.gov/pubmed/?term=24359163
8. https://www.ncbi.nlm.nih.gov/pubmed/?term=25896363