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Molecule
Beryllium Carbide
CAS: 506-66-1 · CBe2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 506-66-1
- Molecular Formula
- CBe2
- Molecular Mass
- 30.04 g/mol
Identifiers
CAS Registry Number
506-66-1
SMILES
[Be].[Be].[C]
InChI Key
UQVOJETYKFAIRZ-UHFFFAOYSA-N
InChI
InChI=1S/C.2Be
Names and Synonyms
- Beryllium Carbide Synonym
- Beryllium carbide (Be2C) Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 30.04 g/mol | CAS Common Chemistry |
| 30.035 g/mol | RDKit | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Beryllium_carbide | CAS Common Chemistry |
| Canonical SMILES | [Be]=C=[Be] | CAS Common Chemistry |
| InChI | InChI=1S/C.2Be | CAS Common Chemistry |
| InChI Key | InChIKey=UQVOJETYKFAIRZ-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Beryllium carbide (Be2C) | CAS Common Chemistry |
| Beryllium carbide | CAS Common Chemistry | |
| Heavy Atom Count | 3 | 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 | -0.6803100000000001 | RDKit |
| -0.6803 | RDKit | |
| Molar Refractivity | 14.751 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.0 | RDKit |
| Exact Mass | 30.0243644 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
9
8
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3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
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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
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MW = 30.04 g/mol. Edit any field — others recompute live.
