Back to Search
Molecule
Sulfur Tetrachloride
CAS: 13451-08-6 · Cl4S
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 13451-08-6
- Molecular Formula
- Cl4S
- Molecular Mass
- 173.88 g/mol
Identifiers
CAS Registry Number
13451-08-6
SMILES
ClS(Cl)(Cl)Cl
InChI Key
JMPVZWBJWHQJDD-UHFFFAOYSA-N
InChI
InChI=1S/Cl4S/c1-5(2,3)4
Names and Synonyms
- Sulfur Tetrachloride Synonym
- Sulfur chloride (SCl4), (T-4)- Synonym
- Sulfur chloride (SCl4) Synonym
- Sulfur tetrachloride Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 173.88 g/mol | CAS Common Chemistry |
| 173.87900000000002 g/mol | RDKit | |
| 173.879 g/mol | RDKit | |
| 173.86 g/mol | chempirical lib | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Sulfur_tetrachloride | CAS Common Chemistry |
| Canonical SMILES | ClS(Cl)(Cl)Cl | CAS Common Chemistry |
| InChI | InChI=1S/Cl4S/c1-5(2,3)4 | CAS Common Chemistry |
| InChI Key | InChIKey=JMPVZWBJWHQJDD-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Sulfur tetrachloride | CAS Common Chemistry |
| Heavy Atom Count | 5 | 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 | 3.4061999999999992 | RDKit |
| 3.4062 | RDKit | |
| 3.36 | chempirical lib | |
| Molar Refractivity | 31.003 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.0 | RDKit |
| Exact Mass | 171.84748172 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
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.
External Resources
Convert
Quick conversion
MW = 173.88 g/mol. Edit any field — others recompute live.
