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Uranyl Nitrate Hexahydrate
CAS: 13520-83-7 | H12N2O14U
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
13520-83-7
Molecular Formula:
H12N2O14U
Molecular Mass:
502.12 g/mol
Names and Synonyms:
Uranyl Nitrate Hexahydrate
Uranium dioxide dinitrate, hexahydrate
Uranyl dinitrate hexahydrate
Dinitratodioxouranium hexahydrate
Uranium, bis(nitrato-κO)dioxo-, hydrate (1:6), (T-4)-
Uranium, dinitratodioxo-, hexahydrate
Uranium, bis(nitrato-O)dioxo-, hexahydrate, (T-4)-
Uranyl nitrate hexahydrate
Identifiers:
SMILES:
O.O.O.O.O.O.O=[N+]([O-])[O-].O=[N+]([O-])[O-].[O].[O].[U+2]
InChI:
InChI=1S/2NO3.6H2O.2O.U/c2*2-1(3)4;;;;;;;;;/h;;6*1H2;;;/q2*-1;;;;;;;;;+2
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 | 502.12 g/mol | CAS Common Chemistry |
| 502.125 g/mol | RDKit | |
| 502.079641264 g/mol | RDKit | |
| Canonical SMILES | O=N(=O)O[U](=O)(=O)ON(=O)=O.O | CAS Common Chemistry |
| InChI | InChI=1S/2NO3.6H2O.2O.U/c2*2-1(3)4;;;;;;;;;/h;;6*1H2;;;/q2*-1;;;;;;;;;+2 | CAS Common Chemistry |
| InChI Key | InChIKey=LPWRMIDZYQRIKR-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Uranyl nitrate hexahydrate | CAS Common Chemistry |
| Heavy Atom Count | 17 | RDKit |
| Hydrogen Bond Acceptors | 6 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 378.4 Ų | RDKit |
| LogP | -5.663999999999996 | RDKit |
| Molar Refractivity | 43.778600000000026 | RDKit |
