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Molecule
Zirconium(Iv) Silicate
CAS: 10101-52-7 · H4O4SiZr
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 10101-52-7
- Molecular Formula
- H4O4SiZr
- Molecular Mass
- 187.34 g/mol
Identifiers
CAS Registry Number
10101-52-7
SMILES
O[Si](O)(O)O.[Zr]
InChI Key
IMNMWKFKHDPTSB-UHFFFAOYSA-N
InChI
InChI=1S/H4O4Si.Zr/c1-5(2,3)4;/h1-4H;
Names and Synonyms
- Zirconium(Iv) Silicate Synonym
- Silicic acid (H4SiO4), zirconium(4+) salt (1:1) Synonym
- Zirconium silicate (Zr(SiO4)) Synonym
- Silicon zirconium oxide (ZrSiO4) Synonym
- Zirconium silicon oxide (ZrSiO4) Synonym
- Zirconium silicate Synonym
- Silicon zirconium oxide (SiZrO4) Synonym
- Excelopax Synonym
- Zirconium orthosilicate (ZrSiO4) Synonym
- Micro-Pax Synonym
- Zircosil Synonym
- TAM 418 Synonym
- Zirconium silicate (ZrO2.SiO2) Synonym
- Zirconium silicon oxide Synonym
- MZ 1000B Synonym
- Micro-Pax 20A Synonym
- Zircosil 1 Synonym
- Zircon 30MY Synonym
- A-PAX-SA Synonym
- Oscal 1224 Synonym
- Zirconium orthosilicate Synonym
- Micro-Pax SP Synonym
- Silicon zirconium oxide Si0.5Zr0.5O2 Synonym
- Zirconium silicate (Zr0.5(SiO4)0.5) Synonym
- Zircon Flour 100 Synonym
- Zircon Sand CRL Synonym
- Zirconium silicate (Zr0.5Si0.5O2) Synonym
- Minopet Synonym
- Micro-Pax SS Synonym
- Zircon Flour 600 Synonym
- MZ 50B Synonym
- Micro-Pax S Synonym
- ZS B0.07 Synonym
- A-PAX-UF Synonym
- OZ-S 1 Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 187.34 g/mol | CAS Common Chemistry |
| 187.338 g/mol | RDKit | |
| 191.37 g/mol | chempirical lib | |
| Density | 4.56 g/cm³ | CAS Common Chemistry |
| 4.560 g/cm3 | CAS Common Chemistry | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Zirconium(IV)_silicate | CAS Common Chemistry |
| Canonical SMILES | [Zr].O[Si](O)(O)O | CAS Common Chemistry |
| InChI | InChI=1S/H4O4Si.Zr/c1-5(2,3)4;/h1-4H; | CAS Common Chemistry |
| InChI Key | InChIKey=IMNMWKFKHDPTSB-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 2550 °C | CAS Common Chemistry |
| Name | Zirconium silicate (Zr(SiO4)) | CAS Common Chemistry |
| Zirconium(IV) silicate | CAS Common Chemistry | |
| Heavy Atom Count | 6 | RDKit |
| Hydrogen Bond Acceptors | 4 | RDKit |
| Hydrogen Bond Donors | 4 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 80.92 Ų | RDKit |
| LogP | -2.6113 | RDKit |
| Molar Refractivity | 14.629199999999999 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.0 | RDKit |
| Exact Mass | 185.892589538 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
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200 ppm
180
160
140
120
100
80
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40
20
0 ppm
| 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.
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MW = 187.34 g/mol; density = 4.560 g/mL. Edit any field — others recompute live.
