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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.

External Resources

All Properties

Comprehensive physical and chemical properties

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

Physical Properties

Property Value Source
LogP -0.15839999999999999 RDKit
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
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

Molar

Property Value Source
Molar Refractivity 16.4076 RDKit

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