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Fluorozirconic Acid
CAS: 12021-95-3 | H2F6Zr
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
12021-95-3
Molecular Formula:
H2F6Zr
Molecular Mass:
207.23 g/mol
Names and Synonyms:
Fluorozirconic Acid
Zirconate(2-), hexafluoro-, hydrogen (1:2), (OC-6-11)-
Zirconate(2-), hexafluoro-, dihydrogen
Zirconate(2-), hexafluoro-, dihydrogen, (OC-6-11)-
Hydrogen hexafluorozirconate(IV)
Fluozirconic(IV) acid (H2ZrF6)
Dihydrogen hexafluorozirconate(2-)
Fluorozirconic acid
Hydrogen zirconium fluoride (H2ZrF6)
Hexafluorozirconium acid
Nanotex ZR 16
Identifiers:
SMILES:
F.F.[F-].[F-].[F-].[F-].[Zr+4]
InChI:
InChI=1S/6FH.Zr/h6*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 | 207.23 g/mol | CAS Common Chemistry |
| 207.228 g/mol | RDKit | |
| 205.910773784 g/mol | RDKit | |
| Canonical SMILES | [H+].[F-][Zr+4]([F-])([F-])([F-])([F-])[F-] | CAS Common Chemistry |
| InChI | InChI=1S/6FH.Zr/h6*1H;/q;;;;;;+4/p-4 | CAS Common Chemistry |
| InChI Key | InChIKey=DXIGZHYPWYIZLM-UHFFFAOYSA-J | CAS Common Chemistry |
| Name | Fluorozirconic acid | CAS Common Chemistry |
| Heavy Atom Count | 7 | 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 | -11.6815 | RDKit |
| Molar Refractivity | 5.006 | RDKit |
