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Manganese(Ii) Carbonate
CAS: 598-62-9 | CH2MnO3
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
598-62-9
Molecular Formula:
CH2MnO3
Molecular Weight:
116.96200000000002 g/mol
Names and Synonyms:
Manganese(Ii) Carbonate
Carbonic acid, manganese(2+) salt (1:1)
Manganese(II) carbonate
Manganese carbonate (MnCO3)
Manganese carbonate
Carbonic acid manganese(2+) salt
Manganese carbonate (1:1)
Manganous carbonate
Manganese(2+) carbonate (1:1)
Manganese(2+) carbonate
Carbonic acid manganese salt (1:1)
Manganese monocarbonate
Identifiers:
SMILES:
O=C(O)O.[Mn]
InChI:
InChI=1S/CH2O3.Mn/c2-1(3)4;/h(H2,2,3,4);
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
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8
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3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
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120
100
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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
Physical Properties
| Property | Value | Source |
|---|---|---|
| molecular_mass | 116.96 g/mol | Legacy Database |
| density | 3.70 g/cm³ | Legacy Database |
| wikipedia_url | https://en.wikipedia.org/wiki/Manganese(II)_carbonate None | Legacy Database |
| cas-canonical-smile | [Mn].O=C(O)O None | Legacy Database |
| cas-density | 3.7 g/cm3 None | Legacy Database |
| cas-inchi | InChI=1S/CH2O3.Mn/c2-1(3)4;/h(H2,2,3,4); None | Legacy Database |
| cas-inchi-key | InChIKey=SDPBZSAJSUJVAT-UHFFFAOYSA-N None | Legacy Database |
| LogP | 0.21989999999999998 | RDKit |
| cas-name | Manganese carbonate None | Legacy Database |
| wikipedia-name | Manganese(II) carbonate None | Legacy Database |
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 116.96200000000002 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 116.93843902399999 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 5 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 1 count | RDKit |
| Hydrogen Bond Donors | 2 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 | 57.53 Ų | RDKit |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 10.6536 | RDKit |
