1453-58-3
| Name | 3-Methylpyrazole |
| CAS | 1453-58-3 |
| EINECS(EC#) | 215-925-7 |
| Molecular Formula | C4H6N2 |
| MDL Number | MFCD00005240 |
| Molecular Weight | 82.1 |
| MOL File | 1453-58-3.mol |
Chemical Properties
| Appearance | clear light yellow liquid |
| Melting point | 36.5°C |
| Boiling point | 204 °C (lit.) |
| density | 1.02 g/mL at 25 °C(lit.) |
| vapor pressure | 1.82hPa at 20℃ |
| refractive index | n |
| Fp | 200 °F |
| storage temp. | Inert atmosphere,Room Temperature |
| solubility | DMSO (Sparingly), Methanol (Sparingly) |
| form | Liquid |
| pka | 14.56±0.10(Predicted) |
| color | Clear light yellow |
| Water Solubility | miscible |
| Detection Methods | GC,NMR |
| BRN | 1454 |
| InChI | 1S/C4H6N2/c1-4-2-3-5-6-4/h2-3H,1H3,(H,5,6) |
| InChIKey | XKVUYEYANWFIJX-UHFFFAOYSA-N |
| SMILES | Cc1cc[nH]n1 |
| LogP | 0.475 at 25℃ |
Safety Data
| Symbol(GHS) |    GHS05,GHS07,GHS08 |
| Signal word | Danger |
| Hazard statements | H302-H314-H361 |
| Precautionary statements | P201-P280-P301+P312+P330-P303+P361+P353-P305+P351+P338+P310-P308+P313 |
| Hazard Codes | Xn |
| Risk Statements | |
| Safety Statements | |
| RIDADR | 2810 |
| WGK Germany | 3 |
| RTECS | UQ7340000 |
| F | 10 |
| REACH Registrations | Active |
| HazardClass | 6.1(b) |
| PackingGroup | III |
| HS Code | 29331990 |
| Storage Class | 6.1C - Combustible acute toxic Cat.3 toxic compounds or compounds which causing chronic effects |
| Hazard Classifications | Acute Tox. 4 Oral Eye Dam. 1 Repr. 1B Skin Corr. 1B STOT RE 2 |