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Molecule
Palladium Dihydroxide
CAS: 12135-22-7 · H2O2Pd
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 12135-22-7
- Molecular Formula
- H2O2Pd
- Molecular Mass
- 140.43 g/mol
Identifiers
CAS Registry Number
12135-22-7
SMILES
[OH-].[OH-].[Pd+2]
InChI Key
NXJCBFBQEVOTOW-UHFFFAOYSA-L
InChI
InChI=1S/2H2O.Pd/h2*1H2;/q;;+2/p-2
Names and Synonyms
- Palladium Dihydroxide Common Name
- Palladium hydroxide (Pd(OH)2) Synonym
- Palladium dihydroxide Synonym
- Palladium(II) hydroxide Synonym
- Pearlman's catalyst Synonym
- Escat 1951 Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 140.43 g/mol | CAS Common Chemistry |
| 140.434 g/mol | RDKit | |
| 144.466 g/mol | chempirical lib | |
| Canonical SMILES | O[Pd]O | CAS Common Chemistry |
| InChI | InChI=1S/2H2O.Pd/h2*1H2;/q;;+2/p-2 | CAS Common Chemistry |
| InChI Key | InChIKey=NXJCBFBQEVOTOW-UHFFFAOYSA-L | CAS Common Chemistry |
| Name | Palladium dihydroxide | CAS Common Chemistry |
| Heavy Atom Count | 3 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 60.0 Ų | RDKit |
| LogP | -0.35609999999999997 | RDKit |
| -0.3561 | RDKit | |
| Molar Refractivity | 3.8716 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.0 | RDKit |
| Exact Mass | 139.908965304 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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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 = 140.43 g/mol. Edit any field — others recompute live.
Related
Related molecules
Other compounds with formula H2O2Pd.
