Back to Search
Molecule
Sodium Perchlorate Monohydrate
CAS: 7791-07-3 · H3ClNaO5
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 7791-07-3
- Molecular Formula
- H3ClNaO5
- Molecular Mass
- 141.46 g/mol
Identifiers
CAS Registry Number
7791-07-3
SMILES
O.[Na].[O-][Cl+3]([O-])([O-])O
InChI Key
SOAFTOVKEPSSML-UHFFFAOYSA-N
InChI
InChI=1S/ClHO4.Na.H2O/c2-1(3,4)5;;/h(H,2,3,4,5);;1H2
Names and Synonyms
- Sodium Perchlorate Monohydrate Common Name
- Perchloric acid, sodium salt, monohydrate Synonym
- Sodium perchlorate monohydrate Synonym
- Sodium perchlorate (NaClO4) monohydrate Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 141.46 g/mol | CAS Common Chemistry |
| 141.462 g/mol | RDKit | |
| 142.467 g/mol | chempirical lib | |
| Canonical SMILES | [Na].O=Cl(=O)(=O)O.O | CAS Common Chemistry |
| InChI | InChI=1S/ClHO4.Na.H2O/c2-1(3,4)5;;/h(H,2,3,4,5);;1H2 | CAS Common Chemistry |
| InChI Key | InChIKey=SOAFTOVKEPSSML-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 472 °C | CAS Common Chemistry |
| Name | Sodium perchlorate monohydrate | CAS Common Chemistry |
| Heavy Atom Count | 7 | RDKit |
| Hydrogen Bond Acceptors | 4 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 120.91000000000001 Ų | RDKit |
| 120.91 Ų | RDKit | |
| LogP | -5.329499999999999 | RDKit |
| -5.3295 | RDKit | |
| Molar Refractivity | 11.586599999999999 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.0 | RDKit |
| Exact Mass | 140.956670156 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
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.
External Resources
Convert
Quick conversion
MW = 141.46 g/mol. Edit any field — others recompute live.
