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Chloric Acid, Thallium(1+) Salt
CAS: 13453-30-0 | HClO3Tl
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
13453-30-0
Molecular Formula:
HClO3Tl
Molecular Mass:
288.84 g/mol
Names and Synonyms:
Chloric Acid, Thallium(1+) Salt
Chloric acid, thallium(1+) salt
Thallium chlorate
Thallium chlorate (TlClO3)
Identifiers:
SMILES:
[O-][Cl+2]([O-])O.[Tl]
InChI:
InChI=1S/ClHO3.Tl/c2-1(3)4;/h(H,2,3,4);
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 | 288.84 g/mol | CAS Common Chemistry |
| 288.841 g/mol | RDKit | |
| 288.935849072 g/mol | RDKit | |
| Canonical SMILES | [Tl].O=Cl(=O)O | CAS Common Chemistry |
| InChI | InChI=1S/ClHO3.Tl/c2-1(3)4;/h(H,2,3,4); | CAS Common Chemistry |
| InChI Key | InChIKey=LDHUHZVKQUHBKO-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Chloric acid, thallium(1+) salt | CAS Common Chemistry |
| Heavy Atom Count | 5 | RDKit |
| Hydrogen Bond Acceptors | 3 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 66.35 Ų | RDKit |
| LogP | -3.3158 | RDKit |
| Molar Refractivity | 7.972799999999999 | RDKit |
