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Scandium Nitrate
CAS: 13465-60-6 | HNO3Sc
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
13465-60-6
Molecular Formula:
HNO3Sc
Molecular Weight:
107.96800000000002 g/mol
Names and Synonyms:
Scandium Nitrate
Nitric acid, scandium(3+) salt (3:1)
Nitric acid, scandium(3+) salt
Scandium nitrate
Scandium nitrate (Sc(NO3)3)
Scandium trinitrate
Scandium(3+) nitrate
Tris(nitrato-O,O′)scandium
Identifiers:
SMILES:
O=[N+]([O-])O.[Sc]
InChI:
InChI=1S/HNO3.Sc/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
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 107.96800000000002 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 107.951554792 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 5 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 | 63.370000000000005 Ų | RDKit |
Physical Properties
| Property | Value | Source |
|---|---|---|
| LogP | -0.3502 | RDKit |
| molecular_mass | 107.97 g/mol | Legacy Database |
| wikipedia_url | https://en.wikipedia.org/wiki/Scandium_nitrate None | Legacy Database |
| cas-canonical-smile | [Sc].O=N(=O)O None | Legacy Database |
| cas-inchi | InChI=1S/HNO3.Sc/c2-1(3)4;/h(H,2,3,4); None | Legacy Database |
| cas-inchi-key | InChIKey=SPSBXWARWOLNDA-UHFFFAOYSA-N None | Legacy Database |
| cas-name | Scandium nitrate None | Legacy Database |
| wikipedia-name | Scandium nitrate None | Legacy Database |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 8.7809 | RDKit |
