ContaminantDB: SODIUM SULFATE

Identification Taxonomy Biological Properties Physical Properties Toxicity Profile Spectra Concentrations Links References XML

Record Information

Version

1.0

Creation Date

2016-05-19 02:26:58 UTC

Update Date

2016-11-09 01:09:56 UTC

Accession Number

CHEM007529

Identification

Common Name

SODIUM SULFATE

Class

Small Molecule

Description

Contaminant Sources

EAFUS Chemicals
FooDB Chemicals
HPV EPA Chemicals

Contaminant Type

Not Available

Chemical Structure

MOL SDF PDB SMILES InChI

Synonyms

Value	Source
Disodium sulfate decahydrate	ChEBI
Glauber's salt	ChEBI
Glaubersalz	ChEBI
Na2SO4.10H2O	ChEBI
Sodium sulphate decahydrate	ChEBI
Sodium sulfate hydrate	Kegg
Natrium sulfuricum	Kegg
Natrii sulfus	Kegg
Disodium sulfuric acid decahydric acid	Generator
Disodium sulphate decahydrate	Generator
Disodium sulphuric acid decahydric acid	Generator
Sodium sulfuric acid decahydric acid	Generator
Sodium sulphuric acid decahydric acid	Generator
Sodium sulfuric acid hydric acid	Generator
Sodium sulphate hydrate	Generator
Sodium sulphuric acid hydric acid	Generator
Natrium sulphuricum	Generator
Natrii sulphus	Generator
Sodium sulfuric acid	Generator
Sodium sulphate	Generator
Sodium sulphuric acid	Generator
Sodium sulfate decahydrate	Generator
Puxiao	MeSH
Sodium sulfate, decahydrate	MeSH
Thenardite	MeSH
Natrii sulphas	MeSH
Sodium hydrosulfate	MeSH
Disodium sulfate	MeSH
Sodium bisulfate	MeSH
Sodium bisulfate, monohydrate	MeSH
Sodium sulfate	MeSH
Sodium sulfate, 35S-labeled CPD	MeSH
Mangxiao	MeSH
Mirabilitum	MeSH
Sulfuric acid, monosodium salt	MeSH

Chemical Formula

H₂₀Na₂O₁₄S

Average Molecular Mass

322.195 g/mol

Monoisotopic Mass

322.037 g/mol

CAS Registry Number

7727-73-3

IUPAC Name

disodium decahydrate sulfate

Traditional Name

disodium decahydrate sulfate

SMILES

O.O.O.O.O.O.O.O.O.O.[Na+].[Na+].[O-]S([O-])(=O)=O

InChI Identifier

InChI=1S/2Na.H2O4S.10H2O/c;;1-5(2,3)4;;;;;;;;;;/h;;(H2,1,2,3,4);10*1H2/q2*+1;;;;;;;;;;;/p-2

InChI Key

RSIJVJUOQBWMIM-UHFFFAOYSA-L

Chemical Taxonomy

Description

belongs to the class of inorganic compounds known as alkali metal sulfates. These are inorganic compounds in which the largest oxoanion is sulfate, and in which the heaviest atom not in an oxoanion is an alkali metal.

Kingdom

Inorganic compounds

Super Class

Mixed metal/non-metal compounds

Class

Alkali metal oxoanionic compounds

Sub Class

Alkali metal sulfates

Direct Parent

Alkali metal sulfates

Alternative Parents

Substituents

Alkali metal sulfate
Inorganic sodium salt
Inorganic oxide
Inorganic salt

Molecular Framework

Not Available

External Descriptors

hydrate (CHEBI:32586 )

Biological Properties

Status

Detected and Not Quantified

Origin

Not Available

Cellular Locations

Not Available

Biofluid Locations

Not Available

Tissue Locations

Not Available

Pathways

Not Available

Applications

Not Available

Biological Roles

Not Available

Chemical Roles

Not Available

Physical Properties

State

Not Available

Appearance

Not Available

Experimental Properties

Property	Value
Melting Point	Not Available
Boiling Point	Not Available
Solubility	Not Available

Predicted Properties

Property	Value	Source
logP	-0.84	ChemAxon
pKa (Strongest Acidic)	-3	ChemAxon
Physiological Charge	-2	ChemAxon
Hydrogen Acceptor Count	4	ChemAxon
Hydrogen Donor Count	0	ChemAxon
Polar Surface Area	80.26 Å²	ChemAxon
Rotatable Bond Count	0	ChemAxon
Refractivity	11.53 m³·mol⁻¹	ChemAxon
Polarizability	5.81 Å³	ChemAxon
Number of Rings	0	ChemAxon
Bioavailability	1	ChemAxon
Rule of Five	Yes	ChemAxon
Ghose Filter	No	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	No	ChemAxon

Spectra

Not Available

Toxicity Profile

Route of Exposure

Not Available

Mechanism of Toxicity

Not Available

Metabolism

Not Available

Toxicity Values

Not Available

Lethal Dose

Not Available

Carcinogenicity (IARC Classification)

Not Available

Uses/Sources

Not Available

Minimum Risk Level

Not Available

Health Effects

Not Available

Symptoms

Not Available

Treatment

Not Available

Concentrations

Not Available

External Links

DrugBank ID

DBSALT001892

HMDB ID

HMDB0303547

FooDB ID

FDB015434

Phenol Explorer ID

Not Available

KNApSAcK ID

Not Available

BiGG ID

Not Available

BioCyc ID

Not Available

METLIN ID

Not Available

PDB ID

Not Available

Wikipedia Link

Not Available

Chemspider ID

56401

ChEBI ID

32586

PubChem Compound ID

Not Available

Kegg Compound ID

Not Available

YMDB ID

Not Available

ECMDB ID

Not Available

References

Synthesis Reference

Not Available

MSDS

Not Available

General References

Not Available

SODIUM SULFATE (CHEM007529)

Structure for CHEM007529: SODIUM SULFATE