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Zirconium Nitrate
CAS: 13746-89-9 | HNO3Zr
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
13746-89-9
Molecular Formula:
HNO3Zr
Molecular Weight:
154.23600000000002 g/mol
Names and Synonyms:
Zirconium Nitrate
Nitric acid, zirconium(4+) salt (4:1)
Nitric acid, zirconium(4+) salt
Zirconium nitrate
Zirconium nitrate (Zr(NO3)4)
Zirconium tetranitrate
Tetranitratozirconium
Zirconium(IV) nitrate
Identifiers:
SMILES:
O=[N+]([O-])O.[Zr]
InChI:
InChI=1S/HNO3.Zr/c2-1(3)4;/h(H,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
| Category | Property | Value | Source |
|---|---|---|---|
| Molecular | Molecular Weight | 154.23600000000002 g/mol | RDKit |
| Exact | Exact Molecular Weight | 152.90034729200002 g/mol | RDKit |
| Heavy | Heavy Atom Count | 5 count | RDKit |
| Hydrogen | Hydrogen Bond Acceptors | 2 count | RDKit |
| Hydrogen Bond Donors | 1 count | RDKit | |
| Rotatable | Rotatable Bonds | 0 count | RDKit |
| Aromatic | Aromatic Ring Count | 0 count | RDKit |
| Topological | Topological Polar Surface Area | 63.370000000000005 Ų | RDKit |
| Physical Properties | LogP | -0.3502 | RDKit |
| molecular_mass | 154.24 g/mol | Legacy Database | |
| wikipedia_url | https://en.wikipedia.org/wiki/Zirconium_nitrate | Legacy Database | |
| cas-canonical-smile | [Zr].O=N(=O)O | Legacy Database | |
| cas-inchi | InChI=1S/HNO3.Zr/c2-1(3)4;/h(H,2,3,4); | Legacy Database | |
| cas-inchi-key | InChIKey=FTWGTNVTSDGLFG-UHFFFAOYSA-N | Legacy Database | |
| cas-name | Zirconium nitrate | Legacy Database | |
| wikipedia-name | Zirconium nitrate | Legacy Database | |
| Molar | Molar Refractivity | 8.7809 | RDKit |
