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Molecule
Magnesium Arsenate
CAS: 10103-50-1 · H3AsMgO4
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 10103-50-1
- Molecular Formula
- H3AsMgO4
- Molecular Mass
- 166.25 g/mol
Identifiers
CAS Registry Number
10103-50-1
SMILES
O=[As](O)(O)O.[Mg]
InChI Key
MOJUIGPMTZULIB-UHFFFAOYSA-N
InChI
InChI=1S/AsH3O4.Mg/c2-1(3,4)5;/h(H3,2,3,4,5);
Names and Synonyms
- Magnesium Arsenate Synonym
- Arsenic acid (H3AsO4), magnesium salt (1:?) Synonym
- Arsenic acid (H3AsO4), magnesium salt Synonym
- Magnesium arsenate Synonym
- Arsenic acid magnesium salt Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 166.25 g/mol | CAS Common Chemistry |
| 166.24699999999999 g/mol | RDKit | |
| 166.247 g/mol | RDKit | |
| 168.263 g/mol | chempirical lib | |
| Canonical SMILES | [Mg].O=[As](O)(O)O | CAS Common Chemistry |
| InChI | InChI=1S/AsH3O4.Mg/c2-1(3,4)5;/h(H3,2,3,4,5); | CAS Common Chemistry |
| InChI Key | InChIKey=MOJUIGPMTZULIB-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Magnesium arsenate | CAS Common Chemistry |
| Heavy Atom Count | 6 | RDKit |
| Hydrogen Bond Acceptors | 1 | RDKit |
| Hydrogen Bond Donors | 3 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 77.76 Ų | RDKit |
| LogP | -2.5514 | RDKit |
| Molar Refractivity | 18.8509 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.0 | RDKit |
| Exact Mass | 165.909771776 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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| Shift (ppm) | Multiplicity | Integration | Assignment |
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200 ppm
180
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| 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.
External Resources
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MW = 166.25 g/mol. Edit any field — others recompute live.
