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Thallium(I) Chloride
CAS: 7791-12-0 | ClTl
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
7791-12-0
Molecular Formula:
ClTl
Molecular Mass:
239.84 g/mol
Names and Synonyms:
Thallium(I) Chloride
Thallium chloride (TlCl)
Thallium monochloride
Thallous chloride
Thallium(I) chloride
Thallium chloride
Thallium(1+) chloride
Identifiers:
SMILES:
[Cl-].[Tl+]
InChI:
InChI=1S/ClH.Tl/h1H;/q;+1/p-1
Key Properties
Boiling Point
720 °C
CAS Common Chemistry
Melting Point
430 °C
CAS Common Chemistry
Density
7.00 g/cm³
CAS Common Chemistry
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 | 239.84 g/mol | CAS Common Chemistry |
| 239.836 g/mol | RDKit | |
| 239.94328018 g/mol | RDKit | |
| Density | 7.00 g/cm³ | CAS Common Chemistry |
| 7.004 g/cm3 @ Temp: 30 °C | CAS Common Chemistry | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Thallium(I)_chloride | CAS Common Chemistry |
| Boiling Point | 720 °C | CAS Common Chemistry |
| Canonical SMILES | Cl[Tl] | CAS Common Chemistry |
| InChI | InChI=1S/ClH.Tl/h1H;/q;+1/p-1 | CAS Common Chemistry |
| InChI Key | InChIKey=GBECUEIQVRDUKB-UHFFFAOYSA-M | CAS Common Chemistry |
| Melting Point | 430 °C | CAS Common Chemistry |
| Name | Thallium monochloride | CAS Common Chemistry |
| Thallium(I) chloride | CAS Common Chemistry | |
| Heavy Atom Count | 2 | 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 | -3.3768000000000002 | RDKit |
| Molar Refractivity | 5.754 | RDKit |
