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Sodium Bromate
CAS: 7789-38-0 | HBrNaO3
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
7789-38-0
Molecular Formula:
HBrNaO3
Molecular Mass:
151.90 g/mol
Names and Synonyms:
Sodium Bromate
Bromic acid, sodium salt (1:1)
Bromic acid, sodium salt
Sodium bromate
Neutralizer K 126
Neutralizer K 140
Neutralizer K 938
Sodium bromate (NaBrO3)
Identifiers:
SMILES:
[Na].[O-][Br+2]([O-])O
InChI:
InChI=1S/BrHO3.Na/c2-1(3)4;/h(H,2,3,4);
Key Properties
Melting Point
381 °C
CAS Common Chemistry
Density
3.34 g/cm³
CAS Common Chemistry
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 | 151.90 g/mol | CAS Common Chemistry |
| 151.899 g/mol | RDKit | |
| 150.900675272 g/mol | RDKit | |
| Density | 3.34 g/cm³ | CAS Common Chemistry |
| 3.339 g/cm3 @ Temp: 17.5 °C | CAS Common Chemistry | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Sodium_bromate | CAS Common Chemistry |
| Canonical SMILES | [Na].O=Br(=O)O | CAS Common Chemistry |
| InChI | InChI=1S/BrHO3.Na/c2-1(3)4;/h(H,2,3,4); | CAS Common Chemistry |
| InChI Key | InChIKey=VCHARIXNQOMKDN-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 381 °C | CAS Common Chemistry |
| Name | Sodium bromate | CAS Common Chemistry |
| Heavy Atom Count | 5 | RDKit |
| Hydrogen Bond Acceptors | 3 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 66.35 Ų | RDKit |
| LogP | -3.3158 | RDKit |
| Molar Refractivity | 7.972799999999999 | RDKit |
