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Molecule
Vanadium(V) Oxytrifluoride
CAS: 13709-31-4 · F3OV
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 13709-31-4
- Molecular Formula
- F3OV
- Molecular Mass
- 123.94 g/mol
Identifiers
CAS Registry Number
13709-31-4
SMILES
[F-].[F-].[F-].[O].[V+3]
InChI Key
FXGIDXZUDLFPLD-UHFFFAOYSA-K
InChI
InChI=1S/3FH.O.V/h3*1H;;/q;;;;+3/p-3
Names and Synonyms
- Vanadium(V) Oxytrifluoride Common Name
- Vanadium, trifluorooxo-, (T-4)- Synonym
- Vanadium fluoride oxide (VOF3) Synonym
- Vanadyl fluoride (VOF3) Synonym
- Vanadium, trifluorooxo- Synonym
- Vanadium oxyfluoride (VOF3) Synonym
- Vanadium oxytrifluoride Synonym
- Vanadium oxofluoride (VOF3) Synonym
- Vanadyl trifluoride Synonym
- Vanadium oxide fluoride (VOF3) Synonym
- Vanadium fluoride oxide (VF3O) Synonym
- Vanadium trifluoride monoxide Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 123.94 g/mol | CAS Common Chemistry |
| 123.937 g/mol | RDKit | |
| 130.991 g/mol | chempirical lib | |
| Density | 2.46 g/cm³ | CAS Common Chemistry |
| 2.4591 g/cm3 @ 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 |
| 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 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.0 | RDKit |
| Exact Mass | 123.93408378000002 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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200 ppm
180
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| Shift (ppm) | DEPT | Assignment |
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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 = 123.94 g/mol; density = 2.460 g/mL. Edit any field — others recompute live.
