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Molecule
Cerium(Iii) Chloride
CAS: 7790-86-5 · CeCl3
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 7790-86-5
- Molecular Formula
- CeCl3
- Molecular Mass
- 246.48 g/mol
Identifiers
CAS Registry Number
7790-86-5
SMILES
[Ce+3].[Cl-].[Cl-].[Cl-]
InChI Key
VYLVYHXQOHJDJL-UHFFFAOYSA-K
InChI
InChI=1S/Ce.3ClH/h;3*1H/q+3;;;/p-3
Names and Synonyms
- Cerium(Iii) Chloride Common Name
- Cerium chloride (CeCl3) Synonym
- Cerous chloride Synonym
- Cerium trichloride Synonym
- Cerium chloride Synonym
- Cerium(III) chloride Synonym
- Cerous(III) chloride Synonym
- NSC 84267 Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 246.48 g/mol | CAS Common Chemistry |
| 246.47500000000002 g/mol | RDKit | |
| 246.475 g/mol | RDKit | |
| 252.514 g/mol | chempirical lib | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Cerium(III)_chloride | CAS Common Chemistry |
| Canonical SMILES | Cl[Ce](Cl)Cl | CAS Common Chemistry |
| InChI | InChI=1S/Ce.3ClH/h;3*1H/q+3;;;/p-3 | CAS Common Chemistry |
| InChI Key | InChIKey=VYLVYHXQOHJDJL-UHFFFAOYSA-K | CAS Common Chemistry |
| Melting Point | 788 °C | CAS Common Chemistry |
| Name | Cerium trichloride | CAS Common Chemistry |
| Heavy Atom Count | 4 | 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 | -8.988 | RDKit |
| Molar Refractivity | 0.0 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.0 | RDKit |
| Exact Mass | 244.81199673999998 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 |
|---|
200 ppm
180
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140
120
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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.
External Resources
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MW = 246.48 g/mol. Edit any field — others recompute live.
