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Molecule
Dimethylacetamide Dimethyl Acetal
CAS: 18871-66-4 · C6H15NO2
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 18871-66-4
- Molecular Formula
- C6H15NO2
- Molecular Mass
- 133.19 g/mol
Identifiers
CAS Registry Number
18871-66-4
SMILES
COC(C)(OC)N(C)C
InChI Key
FBZVZUSVGKOWHG-UHFFFAOYSA-N
InChI
InChI=1S/C6H15NO2/c1-6(8-4,9-5)7(2)3/h1-5H3
Names and Synonyms
- Dimethylacetamide Dimethyl Acetal Common Name
- Ethanamine, 1,1-dimethoxy-N,N-dimethyl- Synonym
- Acetamide, N,N-dimethyl-, dimethyl acetal Synonym
- Ethylamine, 1,1-dimethoxy-N,N-dimethyl- Synonym
- 1,1-Dimethoxy-N,N-dimethylethanamine Synonym
- N,N-Dimethylacetamide dimethyl acetal Synonym
- Dimethylacetamide dimethyl acetal Synonym
- 1-(Dimethylamino)-1,1-dimethoxyethane Synonym
- DMF dimethyl acetyl Synonym
- N-(1,1-Dimethoxyethyl)-N,N-dimethylamine Synonym
- (1,1-Dimethoxyethyl)dimethylamine Synonym
- 1,1-Dimethoxy-N,N-dimethylethylamine Synonym
- 1,1-Dimethoxy-N,N-dimethylethan-1-amine Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 133.19 g/mol | CAS Common Chemistry |
| 133.191 g/mol | RDKit | |
| Boiling Point | 118-120 °C | CAS Common Chemistry |
| Canonical SMILES | O(C)C(OC)(N(C)C)C | CAS Common Chemistry |
| InChI | InChI=1S/C6H15NO2/c1-6(8-4,9-5)7(2)3/h1-5H3 | CAS Common Chemistry |
| InChI Key | InChIKey=FBZVZUSVGKOWHG-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Dimethylacetamide dimethyl acetal | CAS Common Chemistry |
| Heavy Atom Count | 9 | RDKit |
| Hydrogen Bond Acceptors | 3 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 3 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 21.700000000000003 Ų | RDKit |
| 21.7 Ų | RDKit | |
| 21.47 Ų | chempirical lib | |
| LogP | 0.5145 | RDKit |
| Molar Refractivity | 36.10999999999999 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 1.0 | RDKit |
| Exact Mass | 133.11027872 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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| 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 = 133.19 g/mol. Edit any field — others recompute live.
Related
Related molecules
Other compounds with formula C6H15NO2.
