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Vanadium(V) Oxytrifluoride
CAS: 13709-31-4 | F3OV
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
13709-31-4
Molecular Formula:
F3OV
Molecular Mass:
123.94 g/mol
Names and Synonyms:
Vanadium(V) Oxytrifluoride
Vanadium, trifluorooxo-, (T-4)-
Vanadium fluoride oxide (VOF3)
Vanadyl fluoride (VOF3)
Vanadium, trifluorooxo-
Vanadium oxyfluoride (VOF3)
Vanadium oxytrifluoride
Vanadium oxofluoride (VOF3)
Vanadyl trifluoride
Vanadium oxide fluoride (VOF3)
Vanadium fluoride oxide (VF3O)
Vanadium trifluoride monoxide
Identifiers:
SMILES:
[F-].[F-].[F-].[O].[V+3]
InChI:
InChI=1S/3FH.O.V/h3*1H;;/q;;;;+3/p-3
Key Properties
Boiling Point
480 °C
CAS Common Chemistry
Melting Point
300 °C
CAS Common Chemistry
Density
2.46 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 | 123.94 g/mol | CAS Common Chemistry |
| 123.937 g/mol | RDKit | |
| 123.93408378000002 g/mol | RDKit | |
| Density | 2.46 g/cm³ | CAS Common Chemistry |
| 2.4591 g/cm3 @ Temp: 20.5 °C | CAS Common Chemistry | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Vanadium(V)_oxytrifluoride | CAS Common Chemistry |
| Boiling Point | 480 °C | CAS Common Chemistry |
| Canonical SMILES | O=[V](F)(F)F | CAS Common Chemistry |
| InChI | InChI=1S/3FH.O.V/h3*1H;;/q;;;;+3/p-3 | CAS Common Chemistry |
| InChI Key | InChIKey=FXGIDXZUDLFPLD-UHFFFAOYSA-K | CAS Common Chemistry |
| Melting Point | 300 °C | CAS Common Chemistry |
| Name | Vanadium, trifluorooxo-, (T-4)- | CAS Common Chemistry |
| Vanadium(V) oxytrifluoride | CAS Common Chemistry | |
| Heavy Atom Count | 5 | RDKit |
| Hydrogen Bond Acceptors | 0 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 28.5 Ų | RDKit |
| LogP | -9.1093 | RDKit |
| Molar Refractivity | 0.6865 | RDKit |
