CALCIUM BROMATE
General Information
| Mainterm | CALCIUM BROMATE |
| Doc Type | NIL |
| CAS Reg.No.(or other ID) | 10102-75-7 |
| Regnum |
136.110 |
From www.fda.gov
Computed Descriptors
Download SDF| 2D Structure | |
| CID | 61478 |
| IUPAC Name | calcium;dibromate |
| InChI | InChI=1S/2BrHO3.Ca/c2*2-1(3)4;/h2*(H,2,3,4);/q;;+2/p-2 |
| InChI Key | GROPHIUSZODNGU-UHFFFAOYSA-L |
| Canonical SMILES | [O-]Br(=O)=O.[O-]Br(=O)=O.[Ca+2] |
| Molecular Formula | Ca(BrO3)2 |
| Wikipedia | calcium bromate |
From Pubchem
Computed Properties
| Property Name | Property Value |
|---|---|
| Molecular Weight | 295.88 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 0 |
| Complexity | 36.5 |
| CACTVS Substructure Key Fingerprint | A A A D c Q A A O A A A G A 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 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 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 | 114.0 |
| Monoisotopic Mass | 293.769 |
| Exact Mass | 295.767 |
| Compound Is Canonicalized | True |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| 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