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Manganese(Ii) Acetylacetonate
CAS: 14024-58-9 | C10H14MnO4
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
14024-58-9
Molecular Formula:
C10H14MnO4
Molecular Mass:
253.16 g/mol
Names and Synonyms:
Manganese(Ii) Acetylacetonate
Manganese, bis(2,4-pentanedionato-κO2,κO4)-
Manganese, bis(2,4-pentanedionato)-
Manganese, bis(2,4-pentanedionato-O,O′)-
Manganese, bis(2,4-pentanedionato-κO,κO′)-
Bis(2,4-pentanedionato-κO2,κO4)manganese
Manganous acetylacetonate
Manganese(II) acetylacetonate
Manganese bis(acetylacetonate)
Acetylacetone manganese(II)
Bis(2,4-pentanedionato)manganese
Bis(acetylacetone)manganese
Manganese(2+) acetylacetonate
Bis(acetylacetonato)manganese(II)
Manganese bis(2,4-pentanedionate)
Manganese(II) bis(acetylacetonate)
Bis(acetylacetonato)manganese
Manganese diacetylacetonate
NSC 177707
NSC 4656
NSC 52334
Identifiers:
SMILES:
CC(=O)[CH-]C(C)=O.CC(=O)[CH-]C(C)=O.[Mn+2]
InChI:
InChI=1S/2C5H7O2.Mn/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
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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 |
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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 | 253.16 g/mol | CAS Common Chemistry |
| 253.156 g/mol | RDKit | |
| 253.02725402800002 g/mol | RDKit | |
| Canonical SMILES | O1=C([CH-]C(=O[Mn+2]12O=C([CH-]C(=O2)C)C)C)C | CAS Common Chemistry |
| InChI | InChI=1S/2C5H7O2.Mn/c2*1-4(6)3-5(2)7;/h2*3H,1-2H3;/q2*-1;+2 | CAS Common Chemistry |
| InChI Key | InChIKey=ZPLKMCLEIAEJIG-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Manganese(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 |