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Molecule
Cobalt Molybdenum Oxide (Comoo4)
CAS: 13762-14-6 · CoMoO
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 13762-14-6
- Molecular Formula
- CoMoO
- Molecular Mass
- 170.87199999999999 g/mol
Identifiers
CAS Registry Number
13762-14-6
SMILES
[Co].[Mo].[O]
InChI Key
QUEGLSKBMHQYJU-UHFFFAOYSA-N
InChI
InChI=1S/Co.Mo.O
Names and Synonyms
- Cobalt Molybdenum Oxide (Comoo4) Synonym
- Cobalt molybdenum oxide (CoMoO4) Synonym
- Molybdic acid (H2MoO4), cobalt(2+) salt (1:1) Synonym
- Cobalt molybdate(VI) (CoMoO4) Synonym
- Molybdenum cobalt oxide (CoMoO4) Synonym
- Cobaltous molybdate Synonym
- Cobalt(2+) molybdate Synonym
- Cobalt molybdate (CoMoO4) Synonym
- Cobalt monomolybdate Synonym
- Molybdenum cobaltate (MoCoO4) Synonym
- NKh 1 (metal oxide) Synonym
- Cobalt molybdate Synonym
- NKh 1 Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Canonical SMILES | [O].[Co].[Mo] | CAS Common Chemistry |
| Density | 4.64 g/cm3 | CAS Common Chemistry |
| 4.64 g/cm³ | CAS Common Chemistry | |
| InChI | InChI=1S/Co.Mo.O | CAS Common Chemistry |
| InChI Key | InChIKey=QUEGLSKBMHQYJU-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Cobalt molybdenum oxide (CoMoO4) | CAS Common Chemistry |
| Molecular Mass | 170.87199999999999 g/mol | RDKit |
| 172.83351782 g/mol | RDKit | |
| 170.872 g/mol | RDKit | |
| 176.93 g/mol | chempirical lib | |
| 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 | 28.5 Ų | RDKit |
| LogP | -0.12380000000000001 | RDKit |
| -0.1238 | RDKit | |
| Molar Refractivity | 0.6865 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.0 | RDKit |
| Exact Mass | 170.87 g/mol | CAS Common Chemistry |
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
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MW = 170.87 g/mol. Edit any field — others recompute live.
