Back to Search
Molecule
SN 25
CAS: 1739-84-0 · C5H8N2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 1739-84-0
- Molecular Formula
- C5H8N2
- Molecular Mass
- 96.13 g/mol
Identifiers
CAS Registry Number
1739-84-0
SMILES
Cc1nccn1C
InChI Key
GIWQSPITLQVMSG-UHFFFAOYSA-N
InChI
InChI=1S/C5H8N2/c1-5-6-3-4-7(5)2/h3-4H,1-2H3
Names and Synonyms
- SN 25 Synonym
- 1,2-Dimethylimidazole Synonym
- 1H-Imidazole, 1,2-dimethyl- Synonym
- Imidazole, 1,2-dimethyl- Synonym
- 1,2-Dimethyl-1H-imidazole Synonym
- 1,2-Dimethylimidazole Synonym
- N,2-Dimethylimidazole Synonym
- PC CAT DMI Synonym
- Toyocat DP 70 Synonym
- SN 25 (vulcanizing agent) Synonym
- Curezol 1,2DMZ Synonym
- NSC 111174 Synonym
- Toyocat DMI Synonym
- Toyocat DM 70 Synonym
- 1,2DMZ Synonym
- Nichigo Imidazole 1,2-DMI Synonym
- Curezol 12DMZ Synonym
- Lupragen DMI Synonym
- Dabco 2040 Synonym
- Dabco 2039 Synonym
- Dabco 2041 Synonym
- Kaolizer 390 Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 96.13 g/mol | CAS Common Chemistry |
| 96.133 g/mol | RDKit | |
| Boiling Point | 206 °C | CAS Common Chemistry |
| Canonical SMILES | N=1C=CN(C1C)C | CAS Common Chemistry |
| InChI | InChI=1S/C5H8N2/c1-5-6-3-4-7(5)2/h3-4H,1-2H3 | CAS Common Chemistry |
| InChI Key | InChIKey=GIWQSPITLQVMSG-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 39-41 °C | CAS Common Chemistry |
| Name | 1,2-Dimethylimidazole | CAS Common Chemistry |
| Heavy Atom Count | 7 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| 1 | RDKit | |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 1 | RDKit |
| Topological Polar Surface Area | 17.82 Ų | RDKit |
| LogP | 0.72852 | RDKit |
| 0.7285 | RDKit | |
| Molar Refractivity | 27.944999999999986 cm³/mol | RDKit |
| Ring Count | 1 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.4 | RDKit |
| Exact Mass | 96.06874825599999 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 = 96.13 g/mol. Edit any field — others recompute live.
Related
Related molecules
Other compounds with formula C5H8N2.
