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Magnesium Carbonate
CAS: 546-93-0 | CH2MgO3
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
546-93-0
Molecular Formula:
CH2MgO3
Molecular Weight:
86.32900000000001 g/mol
Names and Synonyms:
Magnesium Carbonate
C.I. 77713
Magnesium carbonate
Carbonic acid, magnesium salt (1:1)
Magthermo MS-S
Magthermo MS-PS
Magthermo MS-L
ZH 4
Zehui ZH 4
CH 02 (carbonate)
CH 02
CH 01 (carbonate)
CH 01
A 106 (carbonate)
A 106
GP 30N
Upsalite
MSL-AM
MSS
SG-MGC 01
Magnesite MSS
MSPS
Frimiz MZ 1
PMK 75
MSHP
MSL
Magnesium Carbonate Gold Star
TT (carbonate)
TT
CSC Book Saver Spray
CSC Book Saver
Magnesite 33
Magfy
Gold Star (carbonate)
Gold Star
MA 70 (carbonate)
Destab
GP 20
GP 20 (carbonate)
Kimboshi
Apolda
Magnesium carbonate (1:1)
Magnesium carbonate (MgCO3)
Stan-Mag Magnesium Carbonate
DCI Light Magnesium Carbonate
Carbonate magnesium
Identifiers:
SMILES:
O=C(O)O.[Mg]
InChI:
InChI=1S/CH2O3.Mg/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
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
Physical Properties
| Property | Value | Source |
|---|---|---|
| molecular_mass | 86.33 g/mol | Legacy Database |
| density | 3.00 g/cm³ | Legacy Database |
| wikipedia_url | https://en.wikipedia.org/wiki/Magnesium_carbonate None | Legacy Database |
| cas-canonical-smile | [Mg].O=C(O)O None | Legacy Database |
| cas-density | 3.0 g/cm3 None | Legacy Database |
| LogP | -0.15839999999999999 | RDKit |
| cas-inchi | InChI=1S/CH2O3.Mg/c2-1(3)4;/h(H2,2,3,4); None | Legacy Database |
| cas-inchi-key | InChIKey=XNEYCQMMVLAXTN-UHFFFAOYSA-N None | Legacy Database |
| cas-melting-point | 990 °C None | Legacy Database |
| cas-name | Magnesium carbonate None | Legacy Database |
| wikipedia-name | Magnesium carbonate None | Legacy Database |
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 86.32900000000001 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 85.98543562399999 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 | 16.4076 | RDKit |
