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Sodium Carbonate
CAS: 497-19-8 | CH2Na2O3
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
497-19-8
Molecular Formula:
CH2Na2O3
Molecular Weight:
108.004 g/mol
Names and Synonyms:
Sodium Carbonate
Dynamar 5251Q
Soda Ash Light
Lime ash
Soda Light
Dynamar RC 5251Q
Soda Ash Dense
Dense Ash
Light Ash
Suprapur 6395
Dynamar L 13890
Soda Ash Light 4P
V 20N
V Soda
Snowlite 1
Na-X
Carbonic acid, disodium salt
Sodium carbonate, anhydrous
Calcined soda
Soda, calcined
Carbonic acid sodium salt
Bisodium carbonate
Disodium carbonate (Na2CO3)
Disodium carbonate
Sodium carbonate (Na2(CO3))
Soda
Soda ash
Sodium carbonate (2:1)
Sodium carbonate
Carbonic acid disodium salt
Carbonic acid sodium salt (1:2)
Identifiers:
SMILES:
O=C(O)O.[Na].[Na]
InChI:
InChI=1S/CH2O3.2Na/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
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 108.004 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 107.979932484 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 6 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 | -0.5391999999999999 | RDKit |
| molecular_mass | 108.00 g/mol | Legacy Database |
| density | 2.53 g/cm³ | Legacy Database |
| wikipedia_url | https://en.wikipedia.org/wiki/Sodium_carbonate None | Legacy Database |
| cas-canonical-smile | [Na].O=C(O)O None | Legacy Database |
| cas-density | 2.53 g/cm3 None | Legacy Database |
| cas-inchi | InChI=1S/CH2O3.2Na/c2-1(3)4;;/h(H2,2,3,4);; None | Legacy Database |
| cas-inchi-key | InChIKey=RRQYGDABVATUBZ-UHFFFAOYSA-N None | Legacy Database |
| cas-melting-point | 851 °C None | Legacy Database |
| cas-name | Sodium carbonate None | Legacy Database |
| wikipedia-name | Sodium carbonate None | Legacy Database |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 22.1616 | RDKit |
