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Molecule
Sodium Hypophosphite Monohydrate
CAS: 10039-56-2 · H5NaO3P
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 10039-56-2
- Molecular Formula
- H5NaO3P
- Molecular Mass
- 107.00 g/mol
Identifiers
CAS Registry Number
10039-56-2
SMILES
O.O=[PH2]O.[Na]
InChI Key
QPTNVLKFMLEXEM-UHFFFAOYSA-N
InChI
InChI=1S/Na.H3O2P.H2O/c;1-3-2;/h;3H2,(H,1,2);1H2
Names and Synonyms
- Sodium Hypophosphite Monohydrate Common Name
- Phosphinic acid, sodium salt, hydrate (1:1:1) Synonym
- Phosphinic acid, sodium salt, monohydrate Synonym
- Sodium hypophosphite monohydrate Synonym
- Phosphonous acid, monosodium salt, monohydrate Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 107.00 g/mol | CAS Common Chemistry |
| 107.00099999999999 g/mol | RDKit | |
| 107.001 g/mol | RDKit | |
| 108.009 g/mol | chempirical lib | |
| Canonical SMILES | [Na].O=[PH2]O.O | CAS Common Chemistry |
| InChI | InChI=1S/Na.H3O2P.H2O/c;1-3-2;/h;3H2,(H,1,2);1H2 | CAS Common Chemistry |
| InChI Key | InChIKey=QPTNVLKFMLEXEM-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Sodium hypophosphite monohydrate | CAS Common Chemistry |
| Heavy Atom Count | 5 | RDKit |
| Hydrogen Bond Acceptors | 1 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 68.8 Ų | RDKit |
| LogP | -1.5555 | RDKit |
| Molar Refractivity | 21.983099999999997 cm³/mol | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.0 | RDKit |
| Ring Count | 0 | RDKit |
| Exact Mass | 106.98739993 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
9
8
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5
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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
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MW = 107.00 g/mol. Edit any field — others recompute live.
