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Molecule
Silver Trifluoromethanesulfonate
CAS: 2923-28-6 · CHAgF3O3S
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 2923-28-6
- Molecular Formula
- CHAgF3O3S
- Molecular Mass
- 257.95 g/mol
Identifiers
CAS Registry Number
2923-28-6
SMILES
O=S(=O)(O)C(F)(F)F.[Ag]
InChI Key
WCGIGOVLOFXAMG-UHFFFAOYSA-N
InChI
InChI=1S/CHF3O3S.Ag/c2-1(3,4)8(5,6)7;/h(H,5,6,7);
Names and Synonyms
- Silver Trifluoromethanesulfonate Synonym
- Methanesulfonic acid, 1,1,1-trifluoro-, silver(1+) salt (1:1) Synonym
- Methanesulfonic acid, trifluoro-, silver(1+) salt Synonym
- Trifluoromethanesulfonic acid silver(1+) salt Synonym
- Silver triflate Synonym
- Silver (trifluoromethyl)sulfonate Synonym
- Silver(I) trifluoromethanesulfonate Synonym
- Silver trifluoromethanesulfonate Synonym
- Silver(1+) trifluoromethanesulfonate Synonym
- Silver trifluoromethanesulphonate Synonym
- Silver(I) triflate Synonym
- Silver(1+) triflate Synonym
- Silver trifluoromethanesulfonate (AgO3SCF3) Synonym
- Silver trifluoromethanesulfonate (AgCF3SO3) Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 257.95 g/mol | CAS Common Chemistry |
| 257.94499999999994 g/mol | RDKit | |
| 257.945 g/mol | RDKit | |
| 258.946 g/mol | chempirical lib | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Silver_trifluoromethanesulfonate | CAS Common Chemistry |
| Canonical SMILES | [Ag].O=S(=O)(O)C(F)(F)F | CAS Common Chemistry |
| InChI | InChI=1S/CHF3O3S.Ag/c2-1(3,4)8(5,6)7;/h(H,5,6,7); | CAS Common Chemistry |
| InChI Key | InChIKey=WCGIGOVLOFXAMG-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 286 °C | CAS Common Chemistry |
| Name | Silver triflate | CAS Common Chemistry |
| Heavy Atom Count | 9 | 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 |
| 54.37 Ų | RDKit | |
| LogP | 0.3915000000000002 | RDKit |
| 0.3915 | RDKit | |
| Molar Refractivity | 17.603600000000004 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 1.0 | RDKit |
| Exact Mass | 256.86494655200005 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 = 257.95 g/mol. Edit any field — others recompute live.
