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Molecule
Potassium Ethoxide
CAS: 917-58-8 · C2H6KO
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 917-58-8
- Molecular Formula
- C2H6KO
- Molecular Mass
- 85.17 g/mol
Identifiers
CAS Registry Number
917-58-8
SMILES
CCO.[K]
InChI Key
GHVZOJONCUEWAV-UHFFFAOYSA-N
InChI
InChI=1S/C2H6O.K/c1-2-3;/h3H,2H2,1H3;
Names and Synonyms
- Potassium Ethoxide Synonym
- Ethanol, potassium salt (1:1) Synonym
- Ethyl alcohol, potassium salt Synonym
- Potassium ethoxide Synonym
- Ethanol, potassium salt Synonym
- Potassium ethanolate Synonym
- Potassium ethylate Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 85.17 g/mol | CAS Common Chemistry |
| 85.167 g/mol | RDKit | |
| 86.175 g/mol | chempirical lib | |
| Density | 0.89 g/cm³ | CAS Common Chemistry |
| 0.894 g/cm3 | CAS Common Chemistry | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Potassium_ethoxide | CAS Common Chemistry |
| Canonical SMILES | [K].OCC | CAS Common Chemistry |
| InChI | InChI=1S/C2H6O.K/c1-2-3;/h3H,2H2,1H3; | CAS Common Chemistry |
| InChI Key | InChIKey=GHVZOJONCUEWAV-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Potassium ethoxide | CAS Common Chemistry |
| Heavy Atom Count | 4 | RDKit |
| Hydrogen Bond Acceptors | 1 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 20.23 Ų | RDKit |
| LogP | -0.38220000000000004 | RDKit |
| -0.3822 | RDKit | |
| Molar Refractivity | 18.5138 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 1.0 | RDKit |
| Exact Mass | 85.005571492 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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| Shift (ppm) | Multiplicity | Integration | Assignment |
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200 ppm
180
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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.
External Resources
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MW = 85.17 g/mol; density = 0.890 g/mL. Edit any field — others recompute live.
