SODIUM THIOSULFATE
General Information
| Mainterm | SODIUM THIOSULFATE |
| Doc Type | ASP |
| CAS Reg.No.(or other ID) | 10102-17-7 |
| Regnum |
184.1807 |
From www.fda.gov
Computed Descriptors
Download SDF| 2D Structure | |
| CID | 61475 |
| IUPAC Name | disodium;dioxido-oxo-sulfanylidene-$l^{6}-sulfane;pentahydrate |
| InChI | InChI=1S/2Na.H2O3S2.5H2O/c;;1-5(2,3)4;;;;;/h;;(H2,1,2,3,4);5*1H2/q2*+1;;;;;;/p-2 |
| InChI Key | PODWXQQNRWNDGD-UHFFFAOYSA-L |
| Canonical SMILES | O.O.O.O.O.[O-]S(=O)(=S)[O-].[Na+].[Na+] |
| Molecular Formula | H10Na2O8S2 |
| Wikipedia | sodium thiosulfate pentahydrate |
From Pubchem
Computed Properties
| Property Name | Property Value |
|---|---|
| Molecular Weight | 248.172 |
| Hydrogen Bond Donor Count | 5 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 0 |
| Complexity | 82.6 |
| CACTVS Substructure Key Fingerprint | A A A D c c A A P D B g A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A C A A A A A A A A A A A A A A A A A A A A A A A A C A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A = = |
| Topological Polar Surface Area | 109.0 |
| Monoisotopic Mass | 247.961 |
| Exact Mass | 247.961 |
| Compound Is Canonicalized | True |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Isotope Atom Count | 0 |
| Covalently-Bonded Unit Count | 8 |
From Pubchem
Taxonomic Classification
| Kingdom | Inorganic compounds |
|---|---|
| Superclass | Mixed metal/non-metal compounds |
| Class | Alkali metal oxoanionic compounds |
| Subclass | Alkali metal thiosulfates |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Alkali metal thiosulfates |
| Alternative Parents | |
| Molecular Framework | Not available |
| Substituents | Alkali metal thiosulfate - Inorganic sodium salt - Inorganic oxide - Inorganic sulfide - Inorganic salt |
| Description | This compound belongs to the class of inorganic compounds known as alkali metal thiosulfates. These are inorganic compounds in which the largest oxoanion is thiosulfate, and in which the heaviest atom not in an oxoanion is an alkali metal. |
From ClassyFire