Back to Search
Sulfuryl Fluoride
CAS: 2699-79-8 | F2O2S
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
2699-79-8
Molecular Formula:
F2O2S
Molecular Weight:
102.061 g/mol
Names and Synonyms:
Sulfuryl Fluoride
ProFume
Sulfuryl difluoride
Sulfonyl difluoride
Vikane Gas Fumigant
Sulfur fluoride oxide (SF2O2)
Sulfur oxyfluoride (SO2F2)
Sulfur oxide fluoride (SF2O2)
Sulfur difluoride dioxide
Sulfur dioxide difluoride
Sulfonyl fluoride
Sulfur fluoride oxide (SO2F2)
Vikane
Sulfuric oxyfluoride
Sulfuryl fluoride
Identifiers:
SMILES:
O=S(=O)(F)F
InChI:
InChI=1S/F2O2S/c1-5(2,3)4
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
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 102.061 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 101.95870668 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 5 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 2 count | RDKit |
| Hydrogen Bond Donors | 0 count | RDKit |
Rotatable
| Property | Value | Source |
|---|---|---|
| Rotatable Bonds | 0 count | RDKit |
Aromatic
| Property | Value | Source |
|---|---|---|
| Aromatic Ring Count | 0 count | RDKit |
Topological
| Property | Value | Source |
|---|---|---|
| Topological Polar Surface Area | 34.14 Ų | RDKit |
Physical Properties
| Property | Value | Source |
|---|---|---|
| LogP | 0.17020000000000013 | RDKit |
| molecular_mass | 102.06 g/mol | Legacy Database |
| wikipedia_url | https://en.wikipedia.org/wiki/Sulfuryl_fluoride None | Legacy Database |
| cas-boiling-point | -55.38 °C None | Legacy Database |
| cas-canonical-smile | O=S(=O)(F)F None | Legacy Database |
| cas-density | 3.72 x 10-3 g/cm3 None | Legacy Database |
| cas-inchi | InChI=1S/F2O2S/c1-5(2,3)4 None | Legacy Database |
| cas-inchi-key | InChIKey=OBTWBSRJZRCYQV-UHFFFAOYSA-N None | Legacy Database |
| cas-melting-point | -135.82 °C None | Legacy Database |
| cas-name | Sulfonyl fluoride None | Legacy Database |
| wikipedia-name | Sulfuryl fluoride None | Legacy Database |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 11.135800000000001 | RDKit |
