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Nitric Acid, Beryllium Salt, Tetrahydrate
CAS: 13510-48-0 | H5BeNO5
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
13510-48-0
Molecular Formula:
H5BeNO5
Molecular Weight:
108.05399999999999 g/mol
Names and Synonyms:
Nitric Acid, Beryllium Salt, Tetrahydrate
Nitric acid, beryllium salt, tetrahydrate
Beryllium nitrate tetrahydrate
Beryllium dinitrate tetrahydrate
Identifiers:
SMILES:
O.O.O=[N+]([O-])O.[Be]
InChI:
InChI=1S/Be.HNO3.2H2O/c;2-1(3)4;;/h;(H,2,3,4);2*1H2
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
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 108.05399999999999 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 108.02895446 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 7 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 2 count | RDKit |
| Hydrogen Bond Donors | 1 count | RDKit |
Rotatable
| Property | Value | Source |
|---|---|---|
| Rotatable Bonds | 0 count | RDKit |
Aromatic
| Property | Value | Source |
|---|---|---|
| Aromatic Ring Count | 0 count | RDKit |
Topological
| Property | Value | Source |
|---|---|---|
| Topological Polar Surface Area | 126.37 Ų | RDKit |
Physical Properties
| Property | Value | Source |
|---|---|---|
| LogP | -2.3779000000000003 | RDKit |
| molecular_mass | 108.05 g/mol | Legacy Database |
| cas-canonical-smile | [Be].O=N(=O)O.O None | Legacy Database |
| cas-inchi | InChI=1S/Be.HNO3.2H2O/c;2-1(3)4;;/h;(H,2,3,4);2*1H2 None | Legacy Database |
| cas-inchi-key | InChIKey=ZJRKRKSSABGIDW-UHFFFAOYSA-N None | Legacy Database |
| cas-name | Nitric acid, beryllium salt, tetrahydrate None | Legacy Database |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 21.7625 | RDKit |
