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Molecule
Copper(Ii) Nitrate Hemipentahydrate
CAS: 19004-19-4 · H3CuNO4
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 19004-19-4
- Molecular Formula
- H3CuNO4
- Molecular Mass
- 144.57 g/mol
Identifiers
CAS Registry Number
19004-19-4
SMILES
O.O=[N+]([O-])O.[Cu]
InChI Key
VVHXYVGAMODMHK-UHFFFAOYSA-N
InChI
InChI=1S/Cu.HNO3.H2O/c;2-1(3)4;/h;(H,2,3,4);1H2
Names and Synonyms
- Copper(Ii) Nitrate Hemipentahydrate Common Name
- Nitric acid, copper(2+) salt, hydrate (2:5) Synonym
- Copper(2+) nitrate, hydrate (2:5) Synonym
- Copper(II) nitrate, hydrate (2:5) Synonym
- Copper dinitrate, hydrate (2:5) Synonym
- Copper(II) nitrate hemipentahydrate Synonym
- Copper dinitrate hemipentahydrate Synonym
- Cu(NO3)2·2.5H2O Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 144.57 g/mol | CAS Common Chemistry |
| 144.57299999999998 g/mol | RDKit | |
| 144.573 g/mol | RDKit | |
| 145.581 g/mol | chempirical lib | |
| Canonical SMILES | [Cu].O=N(=O)O.O | CAS Common Chemistry |
| InChI | InChI=1S/Cu.HNO3.H2O/c;2-1(3)4;/h;(H,2,3,4);1H2 | CAS Common Chemistry |
| InChI Key | InChIKey=VVHXYVGAMODMHK-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Copper(II) nitrate hemipentahydrate | CAS Common Chemistry |
| Heavy Atom Count | 6 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 94.87 Ų | RDKit |
| LogP | -1.1749 | RDKit |
| -1.15 | chempirical lib | |
| Molar Refractivity | 12.394699999999998 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.0 | RDKit |
| Exact Mass | 143.93580507599998 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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3
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1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
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140
120
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20
0 ppm
| Shift (ppm) | DEPT | Assignment |
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Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
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MW = 144.57 g/mol. Edit any field — others recompute live.
Related
Related molecules
Other compounds with formula H3CuNO4.
