Back to Search
Barium Selenate
CAS: 7787-41-9 | H2BaO4Se
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
7787-41-9
Molecular Formula:
H2BaO4Se
Molecular Mass:
282.30 g/mol
Names and Synonyms:
Barium Selenate
Selenic acid, barium salt (1:1)
Selenic acid (H2SeO4), barium salt (1:1)
Barium selenate
Barium selenate (BaSeO4)
Selcote Ultra
Deposel
Identifiers:
SMILES:
O=[Se](=O)(O)O.[Ba]
InChI:
InChI=1S/Ba.H2O4Se/c;1-5(2,3)4/h;(H2,1,2,3,4)
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
9
8
7
6
5
4
3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
|---|
Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 282.30 g/mol | CAS Common Chemistry |
| 282.29999999999995 g/mol | RDKit | |
| 283.817077044 g/mol | RDKit | |
| Canonical SMILES | [Ba].O=[Se](=O)(O)O | CAS Common Chemistry |
| InChI | InChI=1S/Ba.H2O4Se/c;1-5(2,3)4/h;(H2,1,2,3,4) | CAS Common Chemistry |
| InChI Key | InChIKey=GQNCNDNVQBOGRU-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Barium selenate | CAS Common Chemistry |
| Heavy Atom Count | 6 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 2 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 74.60000000000001 Ų | RDKit |
| LogP | -2.1132 | RDKit |
| Molar Refractivity | 17.3186 | RDKit |
