Back to Search
Molecule
1,3-Dimethyl-2-Imidazolidinone
CAS: 80-73-9 · C5H10N2O
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 80-73-9
- Molecular Formula
- C5H10N2O
- Molecular Mass
- 114.15 g/mol
Identifiers
CAS Registry Number
80-73-9
SMILES
CN1CCN(C)C1=O
InChI Key
CYSGHNMQYZDMIA-UHFFFAOYSA-N
InChI
InChI=1S/C5H10N2O/c1-6-3-4-7(2)5(6)8/h3-4H2,1-2H3
Names and Synonyms
- 1,3-Dimethyl-2-Imidazolidinone Systematic Name
- 2-Imidazolidinone, 1,3-dimethyl- Synonym
- 1,3-Dimethyl-2-imidazolidinone Synonym
- N,N′-Dimethylethyleneurea Synonym
- N,N′-Dimethyl-2-imidazolidinone Synonym
- Rhonite 1 Synonym
- 1,3-Dimethylethyleneurea Synonym
- N,N′-Dimethylimidazolidone Synonym
- Karbomos TsEM Synonym
- N,N′-Dimethylimidazolidinone Synonym
- Dimethylimidazolidinone Synonym
- 1,3-Dimethyl-2-imidazolidone Synonym
- DMEU Synonym
- DMEU (solvent) Synonym
- N,N-Dimethylimidazolidinone Synonym
- N,N-Dimethylethylenediamine cyclic urea Synonym
- DMI Synonym
- 1,3-Dimethylimidazolidinone Synonym
- N,N′-Dimethyl-N,N′-ethyleneurea Synonym
- 1,3-Dimethyl-2-imidazolidindione Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 114.15 g/mol | CAS Common Chemistry |
| 114.14799999999998 g/mol | RDKit | |
| 114.148 g/mol | RDKit | |
| Wikipedia Url | https://en.wikipedia.org/wiki/1,3-Dimethyl-2-imidazolidinone | CAS Common Chemistry |
| Boiling Point | 221 °C | CAS Common Chemistry |
| Canonical SMILES | O=C1N(C)CCN1C | CAS Common Chemistry |
| InChI | InChI=1S/C5H10N2O/c1-6-3-4-7(2)5(6)8/h3-4H2,1-2H3 | CAS Common Chemistry |
| InChI Key | InChIKey=CYSGHNMQYZDMIA-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 8.2 °C | CAS Common Chemistry |
| Name | 1,3-Dimethyl-2-imidazolidinone | CAS Common Chemistry |
| Heavy Atom Count | 8 | RDKit |
| Hydrogen Bond Acceptors | 1 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 23.55 Ų | RDKit |
| 23.09 Ų | chempirical lib | |
| LogP | -0.01639999999999997 | RDKit |
| -0.0164 | RDKit | |
| Molar Refractivity | 30.655999999999988 cm³/mol | RDKit |
| Ring Count | 1 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.8 | RDKit |
| Exact Mass | 114.07931294 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
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.
External Resources
Convert
Quick conversion
MW = 114.15 g/mol. Edit any field — others recompute live.
Related
Related molecules
Other compounds with formula C5H10N2O.
