ZINC FORMALDEHYDE SULFOXYLATE
General Information
| Mainterm | ZINC FORMALDEHYDE SULFOXYLATE |
| CAS Reg.No.(or other ID) | 24887-06-7 |
| Regnum |
175.105 176.170 |
From www.fda.gov
Computed Descriptors
Download SDF| 2D Structure | |
| CID | 159978 |
| IUPAC Name | zinc;hydroxymethanesulfinate |
| InChI | InChI=1S/2CH4O3S.Zn/c2*2-1-5(3)4;/h2*2H,1H2,(H,3,4);/q;;+2/p-2 |
| InChI Key | CAAIULQYGCAMCD-UHFFFAOYSA-L |
| Canonical SMILES | C(O)S(=O)[O-].C(O)S(=O)[O-].[Zn+2] |
| Molecular Formula | C2H6O6S2Zn |
| Wikipedia | zinc formaldehyde sulfoxylate |
From Pubchem
Computed Properties
| Property Name | Property Value |
|---|---|
| Molecular Weight | 255.564 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 0 |
| Complexity | 36.6 |
| CACTVS Substructure Key Fingerprint | A A A D c Y B A O A B g 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 E g Q A C A A A A A A A A A K A A A A A A g I A A A A A A G A A A A A A A A A A A A A A A A A A E 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 | 159.0 |
| Monoisotopic Mass | 253.89 |
| Exact Mass | 253.89 |
| Compound Is Canonicalized | True |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| 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 | 3 |
From Pubchem