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Molecule
Zinc Sulfate Monohydrate
CAS: 7446-19-7 · H4O5SZn
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 7446-19-7
- Molecular Formula
- H4O5SZn
- Molecular Mass
- 181.48 g/mol
Identifiers
CAS Registry Number
7446-19-7
SMILES
O.O=S(=O)(O)O.[Zn]
InChI Key
MZNYADCLSDCSHV-UHFFFAOYSA-N
InChI
InChI=1S/H2O4S.H2O.Zn/c1-5(2,3)4;;/h(H2,1,2,3,4);1H2;
Names and Synonyms
- Zinc Sulfate Monohydrate Common Name
- Sulfuric acid, zinc salt (1:1), monohydrate Synonym
- Zinc mesosulfate (ZnH2SO5) Synonym
- Zinc sulfate monohydrate Synonym
- Zinc(II) sulfate monohydrate Synonym
- ZNS 13 Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 181.48 g/mol | CAS Common Chemistry |
| 181.48399999999998 g/mol | RDKit | |
| 181.484 g/mol | RDKit | |
| 183.483 g/mol | chempirical lib | |
| Canonical SMILES | [Zn].O=S(=O)(O)O.O | CAS Common Chemistry |
| InChI | InChI=1S/H2O4S.H2O.Zn/c1-5(2,3)4;;/h(H2,1,2,3,4);1H2; | CAS Common Chemistry |
| InChI Key | InChIKey=MZNYADCLSDCSHV-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Zinc sulfate monohydrate | CAS Common Chemistry |
| Heavy Atom Count | 7 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 2 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 106.10000000000001 Ų | RDKit |
| 106.1 Ų | RDKit | |
| 115.83 Ų | chempirical lib | |
| LogP | -1.48 | RDKit |
| Molar Refractivity | 17.7912 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.0 | RDKit |
| Exact Mass | 179.907086428 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
9
8
7
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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
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MW = 181.48 g/mol. Edit any field — others recompute live.
