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Titanium Tetrafluoride
CAS: 7783-63-3 | F4Ti
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
7783-63-3
Molecular Formula:
F4Ti
Molecular Mass:
123.86 g/mol
Names and Synonyms:
Titanium Tetrafluoride
Titanium fluoride (TiF4), (T-4)-
Titanium fluoride (TiF4)
Titanium tetrafluoride
Titanium(IV) fluoride
Titanium(4+) fluoride
Identifiers:
SMILES:
[F-].[F-].[F-].[F-].[Ti+4]
InChI:
InChI=1S/4FH.Ti/h4*1H;/q;;;;+4/p-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
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 123.86 g/mol | CAS Common Chemistry |
| 123.85900000000001 g/mol | RDKit | |
| 123.94155918000001 g/mol | RDKit | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Titanium_tetrafluoride | CAS Common Chemistry |
| Canonical SMILES | F[Ti](F)(F)F | CAS Common Chemistry |
| InChI | InChI=1S/4FH.Ti/h4*1H;/q;;;;+4/p-4 | CAS Common Chemistry |
| InChI Key | InChIKey=XROWMBWRMNHXMF-UHFFFAOYSA-J | CAS Common Chemistry |
| Name | Titanium tetrafluoride | 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 | 0.0 Ų | RDKit |
| LogP | -11.9865 | RDKit |
| Molar Refractivity | 0.0 | RDKit |
