Back to Search
Beryllium Sulfide
CAS: 13598-22-6 | BeS
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
13598-22-6
Molecular Formula:
BeS
Molecular Weight:
41.079 g/mol
Names and Synonyms:
Beryllium Sulfide
Common Name
Beryllium sulfide
Synonym
Beryllium monosulfide
Synonym
Beryllium sulfide (BeS)
Synonym
Identifiers:
SMILES:
[Be].[S]
InChI:
InChI=1S/Be.S
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
Physical Properties
| Property | Value | Source |
|---|---|---|
| molecular_mass | 41.08 g/mol | Legacy Database |
| wikipedia_url | https://en.wikipedia.org/wiki/Beryllium_sulfide None | Legacy Database |
| cas-canonical-smile | [Be]=S None | Legacy Database |
| cas-inchi | InChI=1S/Be.S None | Legacy Database |
| cas-inchi-key | InChIKey=FQDSYGKTHDFFCM-UHFFFAOYSA-N None | Legacy Database |
| cas-name | Beryllium sulfide None | Legacy Database |
| wikipedia-name | Beryllium sulfide None | Legacy Database |
| LogP | 0.26739999999999997 | RDKit |
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 41.079 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 40.9842532 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 2 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 0 count | RDKit |
| Hydrogen Bond Donors | 0 count | RDKit |
Rotatable
| Property | Value | Source |
|---|---|---|
| Rotatable Bonds | 0 count | RDKit |
Aromatic
| Property | Value | Source |
|---|---|---|
| Aromatic Ring Count | 0 count | RDKit |
Topological
| Property | Value | Source |
|---|---|---|
| Topological Polar Surface Area | 0.0 Ų | RDKit |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 13.344999999999999 | RDKit |