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Stannous Methanesulfonate
CAS: 53408-94-9 | CH4O3SSn
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
53408-94-9
Molecular Formula:
CH4O3SSn
Molecular Mass:
214.82 g/mol
Names and Synonyms:
Stannous Methanesulfonate
Methanesulfonic acid, tin(2+) salt (2:1)
Methanesulfonic acid, tin(2+) salt
Tin(II) methanesulfonate
Stannous methanesulfonate
Stannous methylsulfonate
Identifiers:
SMILES:
CS(=O)(=O)O.[Sn]
InChI:
InChI=1S/CH4O3S.Sn/c1-5(2,3)4;/h1H3,(H,2,3,4);
Key Properties
Melting Point
-27 °C
CAS Common Chemistry
Density
1.55 g/cm³
CAS Common Chemistry
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
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.
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 214.82 g/mol | CAS Common Chemistry |
| 214.81799999999998 g/mol | RDKit | |
| 215.890309688 g/mol | RDKit | |
| Density | 1.55 g/cm³ | CAS Common Chemistry |
| 1.55 g/cm3 | CAS Common Chemistry | |
| Canonical SMILES | [Sn].O=S(=O)(O)C | CAS Common Chemistry |
| InChI | InChI=1S/CH4O3S.Sn/c1-5(2,3)4;/h1H3,(H,2,3,4); | CAS Common Chemistry |
| InChI Key | InChIKey=PGGZKNHTKRUCJS-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | -27 °C | CAS Common Chemistry |
| Name | Stannous methanesulfonate | CAS Common Chemistry |
| Heavy Atom Count | 6 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 54.370000000000005 Ų | RDKit |
| LogP | -0.8767999999999998 | RDKit |
| Molar Refractivity | 23.226599999999994 | RDKit |
