3H-Pyrazol-3-ol,4,5-dihydro-3,5,5-trimethyl-, 3-(4-nitrobenzoate) 1-oxide structure
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Common Name | 3H-Pyrazol-3-ol,4,5-dihydro-3,5,5-trimethyl-, 3-(4-nitrobenzoate) 1-oxide | ||
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| CAS Number | 65441-90-9 | Molecular Weight | 293.27500 | |
| Density | 1.36g/cm3 | Boiling Point | 440.6ºC at 760mmHg | |
| Molecular Formula | C13H15N3O5 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 220.3ºC | |
| Name | (3,5,5-trimethyl-1-oxido-4H-pyrazol-1-ium-3-yl) 4-nitrobenzoate |
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| Synonym | More Synonyms |
| Density | 1.36g/cm3 |
|---|---|
| Boiling Point | 440.6ºC at 760mmHg |
| Molecular Formula | C13H15N3O5 |
| Molecular Weight | 293.27500 |
| Flash Point | 220.3ºC |
| Exact Mass | 293.10100 |
| PSA | 113.23000 |
| LogP | 2.53020 |
| Index of Refraction | 1.6 |
| InChIKey | APKADHZFJWUMNB-UHFFFAOYSA-N |
| SMILES | CC1(OC(=O)c2ccc([N+](=O)[O-])cc2)CC(C)(C)[N+]([O-])=N1 |
| 3,3,5-trimethyl-5-(4-nitro-benzoyloxy)-4,5-dihydro-3H-pyrazole 2-oxide |