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Molecule
2-(2-Ethoxyethoxy)-2-Methylpropane
CAS: 51422-54-9 · C8H18O2
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 51422-54-9
- Molecular Formula
- C8H18O2
- Molecular Mass
- 146.23 g/mol
Identifiers
CAS Registry Number
51422-54-9
SMILES
CCOCCOC(C)(C)C
InChI Key
NUNQKTCKURIZQX-UHFFFAOYSA-N
InChI
InChI=1S/C8H18O2/c1-5-9-6-7-10-8(2,3)4/h5-7H2,1-4H3
Names and Synonyms
- 2-(2-Ethoxyethoxy)-2-Methylpropane Systematic Name
- Propane, 2-(2-ethoxyethoxy)-2-methyl- Synonym
- 2-(2-Ethoxyethoxy)-2-methylpropane Synonym
- Ethylene glycol tert-butyl ethyl ether Synonym
- Ethyl tert-butyl ethyl diether Synonym
- 1-tert-Butoxy-2-ethoxyethane Synonym
- 1-Ethoxy-2-tert-butoxyethane Synonym
- Additive CMX Synonym
- CMX Synonym
- Ethylene glycol ethyl tert-butyl ether Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 146.23 g/mol | CAS Common Chemistry |
| Density | 0.83 g/cm³ | CAS Common Chemistry |
| 0.8311 g/cm3 @ 20 °C | CAS Common Chemistry | |
| Boiling Point | 148 °C | CAS Common Chemistry |
| Canonical SMILES | O(CC)CCOC(C)(C)C | CAS Common Chemistry |
| InChI | InChI=1S/C8H18O2/c1-5-9-6-7-10-8(2,3)4/h5-7H2,1-4H3 | CAS Common Chemistry |
| InChI Key | InChIKey=NUNQKTCKURIZQX-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | 2-(2-Ethoxyethoxy)-2-methylpropane | CAS Common Chemistry |
| Heavy Atom Count | 10 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 4 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 18.46 Ų | RDKit |
| LogP | 1.838 | RDKit |
| Molar Refractivity | 42.198000000000015 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 1.0 | RDKit |
| Exact Mass | 146.130679816 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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1
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200 ppm
180
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20
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 = 146.23 g/mol; density = 0.830 g/mL. Edit any field — others recompute live.
Related
Related molecules
Other compounds with formula C8H18O2.
