CID9660212
[3-[(E)-[2-(3,5-dimethyl-4-nitropyrazol-1-yl)propanoylhydrazinylidene]methyl]phenyl] 2-bromobenzoate
Also Known As: 1H-Pyrazole-1-aceticacid,alpha,3,5-trimethyl-4-nitro-,[[3-[ oxy]phenyl]methylene]hydrazide|[3-[[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanoylhydrazinylidene]methyl]phenyl] 2-bromobenzoate
CAS: 606483-75-4
| Molecular Formula | C22H20BrN5O5 |
|---|---|
| Molecular Weight | 513.06476 g/mol |
| LogP | 4.10114 |
| Topological Polar Surface Area | 128.72 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 513.06476 |
| Monoisotopic Mass | 513.06476 |
| Heavy Atoms | 33 |
| Complexity | 1253.7236 |
Chemical Identifiers
| CAS Number | 606483-75-4 |
|---|---|
| SMILES | CC1=C(C(=NN1C(C)C(=O)N/N=C/C2=CC(=CC=C2)OC(=O)C3=CC=CC=C3Br)C)[N+](=O)[O-] |
Product Overview
CID9660212 (CAS 606483-75-4), with molecular formula C22H20BrN5O5 and molecular weight 513.06476 g/mol. IUPAC: [3-[(E)-[2-(3,5-dimethyl-4-nitropyrazol-1-yl)propanoylhydrazinylidene]methyl]phenyl] 2-bromobenzoate.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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