5-Nitro-1H-pyrazole-3-carboxylic acid methyl ester
- Product Name5-Nitro-1H-pyrazole-3-carboxylic acid methyl ester
- CAS181585-93-3
- MFC5H5N3O4
- MW171.11
- EINECS
- MOL File181585-93-3.mol
Chemical Properties
| Melting point | 145.5℃ |
| Boiling point | 388.3±22.0 °C(Predicted) |
| Density | 1.545±0.06 g/cm3(Predicted) |
| storage temp. | 2-8°C |
| pka | 5.36±0.10(Predicted) |
| Appearance | White to light brown Solid |
| InChI | InChI=1S/C5H5N3O4/c1-12-5(9)3-2-4(7-6-3)8(10)11/h2H,1H3,(H,6,7) |
| InChIKey | OTINMTPELZSAPX-UHFFFAOYSA-N |
| SMILES | N1C([N+]([O-])=O)=CC(C(OC)=O)=N1 |