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Sodium Ethoxide
CAS: 141-52-6 | C2H6NaO
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
141-52-6
Molecular Formula:
C2H6NaO
Molecular Weight:
69.059 g/mol
Names and Synonyms:
Sodium Ethoxide
Common Name
Ethoxysodium
Synonym
Sodium ethanolate
Synonym
Sodium ethylate
Synonym
Sodium ethoxide
Synonym
Caustic alcohol
Synonym
Ethanol, sodium salt
Synonym
Ethyl alcohol, sodium salt
Synonym
Ethanol, sodium salt (1:1)
Synonym
Sodium ethoxylate
Synonym
Identifiers:
SMILES:
CCO.[Na]
InChI:
InChI=1S/C2H6O.Na/c1-2-3;/h3H,2H2,1H3;
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 | 69.059 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 69.031634092 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 4 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 1 count | RDKit |
| Hydrogen Bond Donors | 1 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 | 20.23 Ų | RDKit |
Physical Properties
| Property | Value | Source |
|---|---|---|
| LogP | -0.38220000000000004 | RDKit |
| molecular_mass | 69.06 g/mol | Legacy Database |
| density | 0.87 g/cm³ | Legacy Database |
| wikipedia_url | https://en.wikipedia.org/wiki/Sodium_ethoxide None | Legacy Database |
| cas-canonical-smile | [Na].OCC None | Legacy Database |
| cas-density | 0.868 g/cm3 None | Legacy Database |
| cas-inchi | InChI=1S/C2H6O.Na/c1-2-3;/h3H,2H2,1H3; None | Legacy Database |
| cas-inchi-key | InChIKey=SSVFMICWXDVRQN-UHFFFAOYSA-N None | Legacy Database |
| cas-name | Sodium ethoxide None | Legacy Database |
| wikipedia-name | Sodium ethoxide None | Legacy Database |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 18.5138 | RDKit |