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Cobalt(Ii) Acetylacetonate
CAS: 14024-48-7 | C10H14CoO4
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
14024-48-7
Molecular Formula:
C10H14CoO4
Molecular Mass:
257.15 g/mol
Names and Synonyms:
Cobalt(Ii) Acetylacetonate
Cobalt, bis(2,4-pentanedionato-κO2,κO4)-, (SP-4-1)-
Cobalt, bis(2,4-pentanedionato)-
Cobalt, bis(2,4-pentanedionato-O,O′)-, (SP-4-1)-
Cobalt, bis(2,4-pentanedionato-κO,κO′)-, (SP-4-1)-
(SP-4-1)-Bis(2,4-pentanedionato-κO2,κO4)cobalt
Cobalt diacetylacetonate
Cobaltous acetylacetonate
Cobalt(II) acetylacetonate
Cobalt(II) bis(acetylacetonate)
Cobalt bis(acetylacetonate)
Bis(acetylacetonato)cobalt
Bis(2,4-pentanedionato)cobalt
Cobalt(2+) acetylacetonate
Bis(acetylacetonato)cobalt(II)
Bis(acetylacetonate)cobalt
Nacem Cobalt
Cobalt(2+) bis(acetylacetonate)
Bis(2,4-pentanedionato)cobalt(II)
NSC 4652
NSC 52329
Cobalt(II) diacetylacetonate
Identifiers:
SMILES:
CC(=O)[CH-]C(C)=O.CC(=O)[CH-]C(C)=O.[Co+2]
InChI:
InChI=1S/2C5H7O2.Co/c2*1-4(6)3-5(2)7;/h2*3H,1-2H3;/q2*-1;+2
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 | 257.15 g/mol | CAS Common Chemistry |
| 257.151 g/mol | RDKit | |
| 257.022403928 g/mol | RDKit | |
| Canonical SMILES | O1=C([CH-]C(=O[Co+2]12O=C([CH-]C(=O2)C)C)C)C | CAS Common Chemistry |
| InChI | InChI=1S/2C5H7O2.Co/c2*1-4(6)3-5(2)7;/h2*3H,1-2H3;/q2*-1;+2 | CAS Common Chemistry |
| InChI Key | InChIKey=BKFAZDGHFACXKY-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Cobalt(II) acetylacetonate | CAS Common Chemistry |
| Heavy Atom Count | 15 | RDKit |
| Hydrogen Bond Acceptors | 4 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 4 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 68.28 Ų | RDKit |
| LogP | 0.73488 | RDKit |
| Molar Refractivity | 51.32400000000003 | RDKit |
